2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine

C12H18N2 — CID 97044872

IUPAC2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine
SMILESCc1ncccc1N[C@@H]1CC[C@H](C)C1
InChIInChI=1S/C12H18N2/c1-9-5-6-11(8-9)14-12-4-3-7-13-10(12)2/h3-4,7,9,11,14H,5-6,8H2,1-2H3/t9-,11+/m0/s1
InChIKeyWFIUOHKGILBDNC-GXSJLCMTSA-N
MW190.29 g/mol
LogP2.99
Rot. Bonds2

About 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine

2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine (PubChem CID 97044872) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine
PubChem CID97044872
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine
SMILESCc1ncccc1N[C@@H]1CC[C@H](C)C1
InChIInChI=1S/C12H18N2/c1-9-5-6-11(8-9)14-12-4-3-7-13-10(12)2/h3-4,7,9,11,14H,5-6,8H2,1-2H3/t9-,11+/m0/s1
InChIKeyWFIUOHKGILBDNC-GXSJLCMTSA-N
XLogP2.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine?
The IUPAC name of 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine (CID 97044872) is 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine.
What is the SMILES notation for 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine?
The canonical SMILES for 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine is Cc1ncccc1N[C@@H]1CC[C@H](C)C1.
What is the InChIKey of 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine?
The InChIKey is WFIUOHKGILBDNC-GXSJLCMTSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-5-6-11(8-9)14-12-4-3-7-13-10(12)2/h3-4,7,9,11,14H,5-6,8H2,1-2H3/t9-,11+/m0/s1.
What are the key properties of 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine?
2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine has a molecular weight of 190.29 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1R,3S)-3-methylcyclopentyl]pyridin-3-amine is sourced from PubChem (CID 97044872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).