2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile

C11H14N4 — CID 71640983

IUPAC2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile
SMILESCN(c1cc(C#N)ccn1)[C@@H]1CCNC1
InChIInChI=1S/C11H14N4/c1-15(10-3-4-13-8-10)11-6-9(7-12)2-5-14-11/h2,5-6,10,13H,3-4,8H2,1H3/t10-/m1/s1
InChIKeyGKNFYPCWLRUGEE-SNVBAGLBSA-N
MW202.26 g/mol
LogP0.75
Rot. Bonds2

About 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile

2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile (PubChem CID 71640983) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile
PubChem CID71640983
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile
SMILESCN(c1cc(C#N)ccn1)[C@@H]1CCNC1
InChIInChI=1S/C11H14N4/c1-15(10-3-4-13-8-10)11-6-9(7-12)2-5-14-11/h2,5-6,10,13H,3-4,8H2,1H3/t10-/m1/s1
InChIKeyGKNFYPCWLRUGEE-SNVBAGLBSA-N
XLogP0.75
TPSA51.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]pyridine-4-carbonitrile
CID 61231862
3-[methyl(pyrrolidin-3-yl)amino]benzonitrile;dihydrochloride
CID 122156861
2-[methyl-(1-methylpiperidin-3-yl)amino]pyridine-4-carbonitrile
CID 62547856
2-[methyl(pyrrolidin-3-yl)amino]quinoline-4-carbonitrile
CID 63883694
2-(pyrrolidin-3-ylamino)pyridine-4-carbonitrile;hydrochloride
CID 71643662
4-N,6-N-dimethyl-4-N-propan-2-yl-6-N-pyrrolidin-3-ylpyrimidine-4,6-diamine
CID 115265972
6-methoxy-N-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 66319644
3-[methyl(pyrrolidin-3-yl)amino]-4-nitrobenzonitrile
CID 113444462
4-[propyl(pyrrolidin-3-yl)amino]pyridine-2-carbonitrile
CID 55205925
5-fluoro-N-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 63301481
2-[methyl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 71641983

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile?
The IUPAC name of 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile (CID 71640983) is 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile.
What is the SMILES notation for 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile?
The canonical SMILES for 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile is CN(c1cc(C#N)ccn1)[C@@H]1CCNC1.
What is the InChIKey of 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile?
The InChIKey is GKNFYPCWLRUGEE-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14N4/c1-15(10-3-4-13-8-10)11-6-9(7-12)2-5-14-11/h2,5-6,10,13H,3-4,8H2,1H3/t10-/m1/s1.
What are the key properties of 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile?
2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile has a molecular weight of 202.26 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(3R)-pyrrolidin-3-yl]amino]pyridine-4-carbonitrile is sourced from PubChem (CID 71640983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).