2-N-butan-2-yl-2-methylpropane-1,2-diamine

C8H20N2 — CID 65382863

IUPAC2-N-butan-2-yl-2-methylpropane-1,2-diamine
SMILESCCC(C)NC(C)(C)CN
InChIInChI=1S/C8H20N2/c1-5-7(2)10-8(3,4)6-9/h7,10H,5-6,9H2,1-4H3
InChIKeyRFSFCDLSJNEYGP-UHFFFAOYSA-N
MW144.26 g/mol
LogP1.11
Rot. Bonds4

About 2-N-butan-2-yl-2-methylpropane-1,2-diamine

2-N-butan-2-yl-2-methylpropane-1,2-diamine (PubChem CID 65382863) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is 2-N-butan-2-yl-2-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-butan-2-yl-2-methylpropane-1,2-diamine
PubChem CID65382863
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Name2-N-butan-2-yl-2-methylpropane-1,2-diamine
SMILESCCC(C)NC(C)(C)CN
InChIInChI=1S/C8H20N2/c1-5-7(2)10-8(3,4)6-9/h7,10H,5-6,9H2,1-4H3
InChIKeyRFSFCDLSJNEYGP-UHFFFAOYSA-N
XLogP1.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N-butan-2-yl-2-methylpropane-1,2-diamine?
The IUPAC name of 2-N-butan-2-yl-2-methylpropane-1,2-diamine (CID 65382863) is 2-N-butan-2-yl-2-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-butan-2-yl-2-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-butan-2-yl-2-methylpropane-1,2-diamine is CCC(C)NC(C)(C)CN.
What is the InChIKey of 2-N-butan-2-yl-2-methylpropane-1,2-diamine?
The InChIKey is RFSFCDLSJNEYGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2/c1-5-7(2)10-8(3,4)6-9/h7,10H,5-6,9H2,1-4H3.
What are the key properties of 2-N-butan-2-yl-2-methylpropane-1,2-diamine?
2-N-butan-2-yl-2-methylpropane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butan-2-yl-2-methylpropane-1,2-diamine is sourced from PubChem (CID 65382863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).