N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine

C12H19N3 — CID 11593670

IUPACN,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine
SMILESCN(C)c1ccnc(C[C@@H]2CCCN2)c1
InChIInChI=1S/C12H19N3/c1-15(2)12-5-7-14-11(9-12)8-10-4-3-6-13-10/h5,7,9-10,13H,3-4,6,8H2,1-2H3/t10-/m0/s1
InChIKeyQFQDIHWRZPKMSK-JTQLQIEISA-N
MW205.31 g/mol
LogP1.44
Rot. Bonds3

About N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine

N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine (PubChem CID 11593670) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine
PubChem CID11593670
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine
SMILESCN(C)c1ccnc(C[C@@H]2CCCN2)c1
InChIInChI=1S/C12H19N3/c1-15(2)12-5-7-14-11(9-12)8-10-4-3-6-13-10/h5,7,9-10,13H,3-4,6,8H2,1-2H3/t10-/m0/s1
InChIKeyQFQDIHWRZPKMSK-JTQLQIEISA-N
XLogP1.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-pyrrolidin-1-yl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridine
CID 11287692
4-(pyrrolidin-2-ylmethyl)pyrimidine
CID 82596500
7-(dimethylamino)-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 84743087
2-[[(2R)-2-[(2R)-1-[[4-(dimethylamino)-2-pyridinyl]methyl]pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]-N,N-dimethylpyridin-4-amine
CID 90164810
3-(pyrrolidin-2-ylmethyl)-1,2-oxazole
CID 82595027
N,N-dimethyl-2-propylpyridin-4-amine
CID 154100065
1,5-dimethyl-3-(pyrrolidin-2-ylmethyl)pyrazole
CID 82600329
5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine
CID 82657762
N-methyl-2-pyridin-2-yl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 28599662
N-methyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 71641999
2-[methyl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 71641983
2-N,2-N-dimethyl-4-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidine-2,4-diamine
CID 104972916

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine?
The IUPAC name of N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine (CID 11593670) is N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine.
What is the SMILES notation for N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine?
The canonical SMILES for N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine is CN(C)c1ccnc(C[C@@H]2CCCN2)c1.
What is the InChIKey of N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine?
The InChIKey is QFQDIHWRZPKMSK-JTQLQIEISA-N. The full InChI is InChI=1S/C12H19N3/c1-15(2)12-5-7-14-11(9-12)8-10-4-3-6-13-10/h5,7,9-10,13H,3-4,6,8H2,1-2H3/t10-/m0/s1.
What are the key properties of N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine?
N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine has a molecular weight of 205.31 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-4-amine is sourced from PubChem (CID 11593670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).