N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide

C15H22N4O2 — CID 124757772

IUPACN-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide
SMILESC[C@H](c1ccncn1)N(C)C(=O)CCN1CCCCC1=O
InChIInChI=1S/C15H22N4O2/c1-12(13-6-8-16-11-17-13)18(2)14(20)7-10-19-9-4-3-5-15(19)21/h6,8,11-12H,3-5,7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyXAMZYGNPBMJKRK-GFCCVEGCSA-N
MW290.37 g/mol
LogP1.40
Rot. Bonds5

About N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide

N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide (PubChem CID 124757772) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide
PubChem CID124757772
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide
SMILESC[C@H](c1ccncn1)N(C)C(=O)CCN1CCCCC1=O
InChIInChI=1S/C15H22N4O2/c1-12(13-6-8-16-11-17-13)18(2)14(20)7-10-19-9-4-3-5-15(19)21/h6,8,11-12H,3-5,7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyXAMZYGNPBMJKRK-GFCCVEGCSA-N
XLogP1.40
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4-(2-oxopyrrolidin-1-yl)-N-[(1S)-1-pyrimidin-4-ylethyl]butanamide
CID 124754851
N-(furan-3-ylmethyl)-N-methyl-3-(2-oxoazepan-1-yl)propanamide
CID 131924744
N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide
CID 134127928
N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-3-(2-oxoazepan-1-yl)propanamide
CID 131922700
ethyl 3-(2-oxoazepan-1-yl)propanoate
CID 14922094
N-[(R)-(2-methylphenyl)-pyridin-4-ylmethyl]-3-(2-oxoazepan-1-yl)propanamide
CID 125165780
1-methyl-3-[(2S)-4-(2-oxopyrrolidin-1-yl)butan-2-yl]-1-(1,3-thiazol-2-ylmethyl)urea
CID 95969174
2-methyl-4-(2-oxopiperidin-1-yl)butanoic acid
CID 12842030
N-cyclopropyl-2-(2-oxoazepan-1-yl)-N-[(1S)-1-pyridin-3-ylethyl]acetamide
CID 95277971
3-[[3-[(dimethylamino)methyl]phenyl]methyl]-1-methyl-1-(1-pyrimidin-4-ylethyl)urea
CID 122572098
N-methyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-3-(2-oxoazepan-1-yl)propanamide
CID 118773707
5-acetamido-2-chloro-N-methyl-N-(1-pyrimidin-4-ylethyl)benzamide
CID 50981802

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide?
The IUPAC name of N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide (CID 124757772) is N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide.
What is the SMILES notation for N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide?
The canonical SMILES for N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide is C[C@H](c1ccncn1)N(C)C(=O)CCN1CCCCC1=O.
What is the InChIKey of N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide?
The InChIKey is XAMZYGNPBMJKRK-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-12(13-6-8-16-11-17-13)18(2)14(20)7-10-19-9-4-3-5-15(19)21/h6,8,11-12H,3-5,7,9-10H2,1-2H3/t12-/m1/s1.
What are the key properties of N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide?
N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide has a molecular weight of 290.37 g/mol, XLogP of 1.40, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide is sourced from PubChem (CID 124757772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).