N-pyrrolidin-3-ylpyridin-2-amine

C9H13N3 — CID 19814840

IUPACN-pyrrolidin-3-ylpyridin-2-amine
SMILESc1ccc(NC2CCNC2)nc1
InChIInChI=1S/C9H13N3/c1-2-5-11-9(3-1)12-8-4-6-10-7-8/h1-3,5,8,10H,4,6-7H2,(H,11,12)
InChIKeyHEMVTRSSBJCRGX-UHFFFAOYSA-N
MW163.22 g/mol
LogP0.86
Rot. Bonds2

About N-pyrrolidin-3-ylpyridin-2-amine

N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 19814840) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound NameN-pyrrolidin-3-ylpyridin-2-amine
PubChem CID19814840
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC NameN-pyrrolidin-3-ylpyridin-2-amine
SMILESc1ccc(NC2CCNC2)nc1
InChIInChI=1S/C9H13N3/c1-2-5-11-9(3-1)12-8-4-6-10-7-8/h1-3,5,8,10H,4,6-7H2,(H,11,12)
InChIKeyHEMVTRSSBJCRGX-UHFFFAOYSA-N
XLogP0.86
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-3-ylpyridin-2-amine
CID 63321128
6-cyclopropyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 83832274
5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 58254860
6-chloro-N-pyrrolidin-3-ylpyridin-2-amine
CID 78996740
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864
3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine
CID 62732869
2-(pyrrolidin-3-ylamino)pyridine-4-carbonitrile;hydrochloride
CID 71643662
N-(1-methylpiperidin-4-yl)pyridin-2-amine;dihydrochloride
CID 174544706
4-N-[(3S)-pyrrolidin-3-yl]pyrimidine-2,4-diamine
CID 59631600
5-bromo-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71636366
N-[(3R)-pyrrolidin-3-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 122441469
N-cyclohexylpyridin-2-amine;methanamine
CID 143850003

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of N-pyrrolidin-3-ylpyridin-2-amine (CID 19814840) is N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for N-pyrrolidin-3-ylpyridin-2-amine is c1ccc(NC2CCNC2)nc1.
What is the InChIKey of N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is HEMVTRSSBJCRGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c1-2-5-11-9(3-1)12-8-4-6-10-7-8/h1-3,5,8,10H,4,6-7H2,(H,11,12).
What are the key properties of N-pyrrolidin-3-ylpyridin-2-amine?
N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 163.22 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 19814840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).