2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine

C17H34N2 — CID 114867730

IUPAC2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
SMILESCC(C)CC(CN)(CC(C)C)N(CC1CC1)C1CC1
InChIInChI=1S/C17H34N2/c1-13(2)9-17(12-18,10-14(3)4)19(16-7-8-16)11-15-5-6-15/h13-16H,5-12,18H2,1-4H3
InChIKeyGWCNPHFDFKOIBK-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.65
Rot. Bonds9

About 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine

2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine (PubChem CID 114867730) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
PubChem CID114867730
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
SMILESCC(C)CC(CN)(CC(C)C)N(CC1CC1)C1CC1
InChIInChI=1S/C17H34N2/c1-13(2)9-17(12-18,10-14(3)4)19(16-7-8-16)11-15-5-6-15/h13-16H,5-12,18H2,1-4H3
InChIKeyGWCNPHFDFKOIBK-UHFFFAOYSA-N
XLogP3.65
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine (CID 114867730) is 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine is CC(C)CC(CN)(CC(C)C)N(CC1CC1)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine?
The InChIKey is GWCNPHFDFKOIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)9-17(12-18,10-14(3)4)19(16-7-8-16)11-15-5-6-15/h13-16H,5-12,18H2,1-4H3.
What are the key properties of 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine?
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine has a molecular weight of 266.47 g/mol, XLogP of 3.65, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-(cyclopropylmethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine is sourced from PubChem (CID 114867730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).