1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine

C12H24N2 — CID 116651488

IUPAC1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine
SMILESCC(CC1CC1)N(C)C(CN)C1CC1
InChIInChI=1S/C12H24N2/c1-9(7-10-3-4-10)14(2)12(8-13)11-5-6-11/h9-12H,3-8,13H2,1-2H3
InChIKeyZLDCNSWIZAJCFM-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.84
Rot. Bonds6

About 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine

1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine (PubChem CID 116651488) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine
PubChem CID116651488
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine
SMILESCC(CC1CC1)N(C)C(CN)C1CC1
InChIInChI=1S/C12H24N2/c1-9(7-10-3-4-10)14(2)12(8-13)11-5-6-11/h9-12H,3-8,13H2,1-2H3
InChIKeyZLDCNSWIZAJCFM-UHFFFAOYSA-N
XLogP1.84
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine (CID 116651488) is 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine is CC(CC1CC1)N(C)C(CN)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine?
The InChIKey is ZLDCNSWIZAJCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9(7-10-3-4-10)14(2)12(8-13)11-5-6-11/h9-12H,3-8,13H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine?
1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine has a molecular weight of 196.34 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine is sourced from PubChem (CID 116651488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).