1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine

C17H28N2 — CID 107179902

IUPAC1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
SMILESCCCNC(C(C)c1ccccn1)C1CCCC1C
InChIInChI=1S/C17H28N2/c1-4-11-19-17(15-9-7-8-13(15)2)14(3)16-10-5-6-12-18-16/h5-6,10,12-15,17,19H,4,7-9,11H2,1-3H3
InChIKeyAONWZWRVILDNNO-UHFFFAOYSA-N
MW260.42 g/mol
LogP3.99
Rot. Bonds6

About 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine

1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine (PubChem CID 107179902) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
PubChem CID107179902
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC Name1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
SMILESCCCNC(C(C)c1ccccn1)C1CCCC1C
InChIInChI=1S/C17H28N2/c1-4-11-19-17(15-9-7-8-13(15)2)14(3)16-10-5-6-12-18-16/h5-6,10,12-15,17,19H,4,7-9,11H2,1-3H3
InChIKeyAONWZWRVILDNNO-UHFFFAOYSA-N
XLogP3.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine (CID 107179902) is 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine is CCCNC(C(C)c1ccccn1)C1CCCC1C.
What is the InChIKey of 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The InChIKey is AONWZWRVILDNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-4-11-19-17(15-9-7-8-13(15)2)14(3)16-10-5-6-12-18-16/h5-6,10,12-15,17,19H,4,7-9,11H2,1-3H3.
What are the key properties of 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine has a molecular weight of 260.42 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 107179902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).