N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine

C17H27N3 — CID 80705366

IUPACN-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine
SMILESCC1(C)CCC(Nc2ccc(N3CCCCC3)nc2)C1
InChIInChI=1S/C17H27N3/c1-17(2)9-8-14(12-17)19-15-6-7-16(18-13-15)20-10-4-3-5-11-20/h6-7,13-14,19H,3-5,8-12H2,1-2H3
InChIKeyOWOUJKKPILPTAB-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.06
Rot. Bonds3

About N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine

N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine (PubChem CID 80705366) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine
PubChem CID80705366
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine
SMILESCC1(C)CCC(Nc2ccc(N3CCCCC3)nc2)C1
InChIInChI=1S/C17H27N3/c1-17(2)9-8-14(12-17)19-15-6-7-16(18-13-15)20-10-4-3-5-11-20/h6-7,13-14,19H,3-5,8-12H2,1-2H3
InChIKeyOWOUJKKPILPTAB-UHFFFAOYSA-N
XLogP4.06
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine (CID 80705366) is N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine is CC1(C)CCC(Nc2ccc(N3CCCCC3)nc2)C1.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine?
The InChIKey is OWOUJKKPILPTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-17(2)9-8-14(12-17)19-15-6-7-16(18-13-15)20-10-4-3-5-11-20/h6-7,13-14,19H,3-5,8-12H2,1-2H3.
What are the key properties of N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine?
N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine has a molecular weight of 273.42 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-6-piperidin-1-ylpyridin-3-amine is sourced from PubChem (CID 80705366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).