2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide

C13H21N5O — CID 62639471

IUPAC2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
SMILESCNC(C)C(=O)NC1CCN(c2ncccn2)CC1
InChIInChI=1S/C13H21N5O/c1-10(14-2)12(19)17-11-4-8-18(9-5-11)13-15-6-3-7-16-13/h3,6-7,10-11,14H,4-5,8-9H2,1-2H3,(H,17,19)
InChIKeyTVUXUTCNEMBGRJ-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.17
Rot. Bonds4

About 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide

2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide (PubChem CID 62639471) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
PubChem CID62639471
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
SMILESCNC(C)C(=O)NC1CCN(c2ncccn2)CC1
InChIInChI=1S/C13H21N5O/c1-10(14-2)12(19)17-11-4-8-18(9-5-11)13-15-6-3-7-16-13/h3,6-7,10-11,14H,4-5,8-9H2,1-2H3,(H,17,19)
InChIKeyTVUXUTCNEMBGRJ-UHFFFAOYSA-N
XLogP0.17
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62728860
(2S)-2-amino-3-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)pentanamide
CID 61172472
2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 61265591
3-methyl-N-[1-oxo-1-[(1-pyrimidin-2-ylpiperidin-4-yl)amino]propan-2-yl]benzamide
CID 47061398
2,2-diphenyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 55705535
2-amino-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanediamide
CID 60846790
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-4-yl)hexanamide
CID 103831283
(3S)-3-cyclohexyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanamide
CID 94816783
N-propan-2-yl-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675626
3,4-dimethyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzamide
CID 110712544
2-(4-methylpiperazin-1-yl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 140936797
N-(1-acetylpiperidin-4-yl)-2-(methylamino)propanamide
CID 62639484

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The IUPAC name of 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide (CID 62639471) is 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The canonical SMILES for 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide is CNC(C)C(=O)NC1CCN(c2ncccn2)CC1.
What is the InChIKey of 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The InChIKey is TVUXUTCNEMBGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-10(14-2)12(19)17-11-4-8-18(9-5-11)13-15-6-3-7-16-13/h3,6-7,10-11,14H,4-5,8-9H2,1-2H3,(H,17,19).
What are the key properties of 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide has a molecular weight of 263.34 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide is sourced from PubChem (CID 62639471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).