N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine

C17H25N5 — CID 125011932

IUPACN-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine
SMILESCCCn1ccnc1CN1CCC[C@H]1c1ccnc(NC)c1
InChIInChI=1S/C17H25N5/c1-3-9-21-11-8-20-17(21)13-22-10-4-5-15(22)14-6-7-19-16(12-14)18-2/h6-8,11-12,15H,3-5,9-10,13H2,1-2H3,(H,18,19)/t15-/m0/s1
InChIKeyVTZPYOKMXWEXNN-HNNXBMFYSA-N
MW299.42 g/mol
LogP3.07
Rot. Bonds6

About N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine

N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine (PubChem CID 125011932) has the molecular formula C17H25N5 and a molecular weight of 299.42 g/mol. Its IUPAC name is N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine
PubChem CID125011932
Molecular FormulaC17H25N5
Molecular Weight299.42 g/mol
Exact Mass299.21
IUPAC NameN-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine
SMILESCCCn1ccnc1CN1CCC[C@H]1c1ccnc(NC)c1
InChIInChI=1S/C17H25N5/c1-3-9-21-11-8-20-17(21)13-22-10-4-5-15(22)14-6-7-19-16(12-14)18-2/h6-8,11-12,15H,3-5,9-10,13H2,1-2H3,(H,18,19)/t15-/m0/s1
InChIKeyVTZPYOKMXWEXNN-HNNXBMFYSA-N
XLogP3.07
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-ethylimidazol-1-yl)-1-[2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]propan-1-one
CID 110105596
N-[[2-[(2R)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 125025430
N-[4-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 110097759
N,N,2-trimethyl-6-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
CID 125022398
N-methyl-4-[(2R)-1-(1,3-thiazol-5-ylmethyl)pyrrolidin-2-yl]pyridin-2-amine
CID 124964991
N-methyl-2-[(2S)-2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]acetamide
CID 124952288
4-[(2S)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-N-methylpyridin-2-amine
CID 125022357
N-[[6-[1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 110095794
N-methyl-4-[(3S)-1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyridin-2-amine
CID 124997573
3-[6-[(2R)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]propanoic acid
CID 95827389
2-methyl-4-[(2R)-1-propylpyrrolidin-2-yl]pyridine
CID 124500080
2-cyclopentyl-1-[2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]ethanone
CID 127246703

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine?
The IUPAC name of N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine (CID 125011932) is N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine.
What is the SMILES notation for N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine?
The canonical SMILES for N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine is CCCn1ccnc1CN1CCC[C@H]1c1ccnc(NC)c1.
What is the InChIKey of N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine?
The InChIKey is VTZPYOKMXWEXNN-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H25N5/c1-3-9-21-11-8-20-17(21)13-22-10-4-5-15(22)14-6-7-19-16(12-14)18-2/h6-8,11-12,15H,3-5,9-10,13H2,1-2H3,(H,18,19)/t15-/m0/s1.
What are the key properties of N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine?
N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine has a molecular weight of 299.42 g/mol, XLogP of 3.07, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine is sourced from PubChem (CID 125011932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).