6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine

C15H25N3 — CID 113320429

IUPAC6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine
SMILESCC(C)CN(c1ccc(CN)nc1)C1CCCC1
InChIInChI=1S/C15H25N3/c1-12(2)11-18(14-5-3-4-6-14)15-8-7-13(9-16)17-10-15/h7-8,10,12,14H,3-6,9,11,16H2,1-2H3
InChIKeyWRAZWTAVIOSFDB-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.95
Rot. Bonds5

About 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine

6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine (PubChem CID 113320429) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine
PubChem CID113320429
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine
SMILESCC(C)CN(c1ccc(CN)nc1)C1CCCC1
InChIInChI=1S/C15H25N3/c1-12(2)11-18(14-5-3-4-6-14)15-8-7-13(9-16)17-10-15/h7-8,10,12,14H,3-6,9,11,16H2,1-2H3
InChIKeyWRAZWTAVIOSFDB-UHFFFAOYSA-N
XLogP2.95
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine (CID 113320429) is 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine is CC(C)CN(c1ccc(CN)nc1)C1CCCC1.
What is the InChIKey of 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine?
The InChIKey is WRAZWTAVIOSFDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-12(2)11-18(14-5-3-4-6-14)15-8-7-13(9-16)17-10-15/h7-8,10,12,14H,3-6,9,11,16H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine?
6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine has a molecular weight of 247.39 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-cyclopentyl-N-(2-methylpropyl)pyridin-3-amine is sourced from PubChem (CID 113320429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).