2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide

C13H21N5O — CID 61265591

IUPAC2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)(N)C(=O)NC1CCN(c2ncccn2)CC1
InChIInChI=1S/C13H21N5O/c1-13(2,14)11(19)17-10-4-8-18(9-5-10)12-15-6-3-7-16-12/h3,6-7,10H,4-5,8-9,14H2,1-2H3,(H,17,19)
InChIKeyCVBGBJPPJBVJKH-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.30
Rot. Bonds3

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

2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide (PubChem CID 61265591) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
PubChem CID61265591
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)(N)C(=O)NC1CCN(c2ncccn2)CC1
InChIInChI=1S/C13H21N5O/c1-13(2,14)11(19)17-10-4-8-18(9-5-10)12-15-6-3-7-16-12/h3,6-7,10H,4-5,8-9,14H2,1-2H3,(H,17,19)
InChIKeyCVBGBJPPJBVJKH-UHFFFAOYSA-N
XLogP0.30
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(ethylamino)-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62832512
N-cyclopropyl-2,2-dimethyl-3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 108957439
2-(methylamino)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62639471
2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide
CID 60866816
3-chloro-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 62728860
2-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-methylpropanamide;dihydrochloride
CID 119862908
2-(4-methylpiperazin-1-yl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 140936797
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
(2S)-2-amino-3-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)pentanamide
CID 61172472
2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide
CID 61264639
2-amino-N-[2-oxo-2-[(1-pyrimidin-2-ylpiperidin-4-yl)amino]ethyl]acetamide
CID 60846789

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The IUPAC name of 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide (CID 61265591) is 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The canonical SMILES for 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide is CC(C)(N)C(=O)NC1CCN(c2ncccn2)CC1.
What is the InChIKey of 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
The InChIKey is CVBGBJPPJBVJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-13(2,14)11(19)17-10-4-8-18(9-5-10)12-15-6-3-7-16-12/h3,6-7,10H,4-5,8-9,14H2,1-2H3,(H,17,19).
What are the key properties of 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide?
2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide has a molecular weight of 263.34 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide is sourced from PubChem (CID 61265591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).