N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide

C17H21N5O — CID 122419905

IUPACN-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1cccc(-c2cnc(N3CCC[C@H]3C)nc2)n1
InChIInChI=1S/C17H21N5O/c1-3-16(23)21-15-8-4-7-14(20-15)13-10-18-17(19-11-13)22-9-5-6-12(22)2/h4,7-8,10-12H,3,5-6,9H2,1-2H3,(H,20,21,23)/t12-/m1/s1
InChIKeyWRVIXFVRPCPJCN-GFCCVEGCSA-N
MW311.39 g/mol
LogP2.88
Rot. Bonds4

About N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide

N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide (PubChem CID 122419905) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide
PubChem CID122419905
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC NameN-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1cccc(-c2cnc(N3CCC[C@H]3C)nc2)n1
InChIInChI=1S/C17H21N5O/c1-3-16(23)21-15-8-4-7-14(20-15)13-10-18-17(19-11-13)22-9-5-6-12(22)2/h4,7-8,10-12H,3,5-6,9H2,1-2H3,(H,20,21,23)/t12-/m1/s1
InChIKeyWRVIXFVRPCPJCN-GFCCVEGCSA-N
XLogP2.88
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methyl-2,6-dioxo-3H-purin-7-yl)-N-[6-[2-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]-2-pyridinyl]acetamide
CID 123794923
6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]pyridin-2-amine
CID 90293508
(2S)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide
CID 90293462
2-[3-methyl-2,6-dioxo-1-(2-oxopropyl)-4,5-dihydropurin-7-yl]-N-[6-[2-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]acetamide
CID 139269462
N-[6-(propanoylamino)-2-pyridinyl]propanamide
CID 835275
2-[3-methyl-2,6-dioxo-1-(2-oxopropyl)purin-7-yl]-N-[6-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]acetamide
CID 118961349
2-methyl-N-[[2-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 113388089
N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propanamide
CID 113030760
N-(6-methyl-2-pyridinyl)propanamide
CID 5057760
N-[[6-(2-methylpyrrolidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 62284708
4-[[5-(2-methylpiperidin-1-yl)-2-pyridinyl]amino]-4-oxobutanoic acid
CID 82034796
(2R)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[2-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]pyrimidin-4-yl]propanamide
CID 126609350

Frequently Asked Questions

What is the IUPAC name of N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide?
The IUPAC name of N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide (CID 122419905) is N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide?
The canonical SMILES for N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide is CCC(=O)Nc1cccc(-c2cnc(N3CCC[C@H]3C)nc2)n1.
What is the InChIKey of N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide?
The InChIKey is WRVIXFVRPCPJCN-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H21N5O/c1-3-16(23)21-15-8-4-7-14(20-15)13-10-18-17(19-11-13)22-9-5-6-12(22)2/h4,7-8,10-12H,3,5-6,9H2,1-2H3,(H,20,21,23)/t12-/m1/s1.
What are the key properties of N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide?
N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide has a molecular weight of 311.39 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]pyrimidin-5-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 122419905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).