6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine

C11H17N3 — CID 94667751

IUPAC6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine
SMILESCc1cccc(NC[C@H]2CCNC2)n1
InChIInChI=1S/C11H17N3/c1-9-3-2-4-11(14-9)13-8-10-5-6-12-7-10/h2-4,10,12H,5-8H2,1H3,(H,13,14)/t10-/m0/s1
InChIKeyGOGVDMSQODUATE-JTQLQIEISA-N
MW191.28 g/mol
LogP1.41
Rot. Bonds3

About 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine

6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine (PubChem CID 94667751) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine
PubChem CID94667751
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine
SMILESCc1cccc(NC[C@H]2CCNC2)n1
InChIInChI=1S/C11H17N3/c1-9-3-2-4-11(14-9)13-8-10-5-6-12-7-10/h2-4,10,12H,5-8H2,1H3,(H,13,14)/t10-/m0/s1
InChIKeyGOGVDMSQODUATE-JTQLQIEISA-N
XLogP1.41
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine?
The IUPAC name of 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine (CID 94667751) is 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine.
What is the SMILES notation for 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine?
The canonical SMILES for 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine is Cc1cccc(NC[C@H]2CCNC2)n1.
What is the InChIKey of 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine?
The InChIKey is GOGVDMSQODUATE-JTQLQIEISA-N. The full InChI is InChI=1S/C11H17N3/c1-9-3-2-4-11(14-9)13-8-10-5-6-12-7-10/h2-4,10,12H,5-8H2,1H3,(H,13,14)/t10-/m0/s1.
What are the key properties of 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine?
6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine has a molecular weight of 191.28 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine is sourced from PubChem (CID 94667751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).