N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine

C51H128N16 — CID 159014268

About N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine

N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine (PubChem CID 159014268) has the molecular formula C51H128N16 and a molecular weight of 965.70 g/mol. Its IUPAC name is N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine.

Molecular Properties

• Compound Name: N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine
• PubChem CID: 159014268
• Molecular Formula: C51H128N16
• Molecular Weight: 965.70 g/mol
• Exact Mass: 965.05
• IUPAC Name: N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine
• SMILES: CC(C)N(CCN)C(C)C.CC(N)CN(C)C.CCN(CC)CCCN.CCN(CC)CCN.CN(C)CCCN.CN1CCCC1CCN.NCCN1CCCC1.NCCN1CCCCC1
• InChI: InChI=1S/C8H20N2.2C7H16N2.C7H18N2.C6H14N2.C6H16N2.2C5H14N2/c1-7(2)10(6-5-9)8(3)4;1-9-6-2-3-7(9)4-5-8;8-4-7-9-5-2-1-3-6-9;1-3-9(4-2)7-5-6-8;7-3-6-8-4-1-2-5-8;1-3-8(4-2)6-5-7;1-5(6)4-7(2)3;1-7(2)5-3-4-6/h7-8H,5-6,9H2,1-4H3;7H,2-6,8H2,1H3;1-8H2;3-8H2,1-2H3;1-7H2;3-7H2,1-2H3;5H,4,6H2,1-3H3;3-6H2,1-2H3
• InChIKey: JSWQSCUVKOJIDC-UHFFFAOYSA-N
• XLogP: 2.72
• TPSA: 234.08 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 16
• Rotatable Bonds: 24
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	965.70
LogP ≤ 5	2.72
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine?

The IUPAC name of N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine (CID 159014268) is N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine.

What is the SMILES notation for N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine?

The canonical SMILES for N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine is CC(C)N(CCN)C(C)C.CC(N)CN(C)C.CCN(CC)CCCN.CCN(CC)CCN.CN(C)CCCN.CN1CCCC1CCN.NCCN1CCCC1.NCCN1CCCCC1.

What is the InChIKey of N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine?

The InChIKey is JSWQSCUVKOJIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2.2C7H16N2.C7H18N2.C6H14N2.C6H16N2.2C5H14N2/c1-7(2)10(6-5-9)8(3)4;1-9-6-2-3-7(9)4-5-8;8-4-7-9-5-2-1-3-6-9;1-3-9(4-2)7-5-6-8;7-3-6-8-4-1-2-5-8;1-3-8(4-2)6-5-7;1-5(6)4-7(2)3;1-7(2)5-3-4-6/h7-8H,5-6,9H2,1-4H3;7H,2-6,8H2,1H3;1-8H2;3-8H2,1-2H3;1-7H2;3-7H2,1-2H3;5H,4,6H2,1-3H3;3-6H2,1-2H3.

What are the key properties of N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine?

N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine has a molecular weight of 965.70 g/mol, XLogP of 2.72, 24 rotatable bonds, 8 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for N',N'-diethylethane-1,2-diamine;N',N'-diethylpropane-1,3-diamine;1-N,1-N-dimethylpropane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine;N',N'-di(propan-2-yl)ethane-1,2-diamine;2-(1-methylpyrrolidin-2-yl)ethanamine;2-piperidin-1-ylethanamine;2-pyrrolidin-1-ylethanamine is sourced from PubChem (CID 159014268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).