2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide

C15H23N5O — CID 60866816

IUPAC2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide
SMILESCC(N)(C(=O)NC1CCCN(c2ncccn2)C1)C1CC1
InChIInChI=1S/C15H23N5O/c1-15(16,11-5-6-11)13(21)19-12-4-2-9-20(10-12)14-17-7-3-8-18-14/h3,7-8,11-12H,2,4-6,9-10,16H2,1H3,(H,19,21)
InChIKeyAQDWTRGRNQFQKM-UHFFFAOYSA-N
MW289.38 g/mol
LogP0.69
Rot. Bonds4

About 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide

2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide (PubChem CID 60866816) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide
PubChem CID60866816
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide
SMILESCC(N)(C(=O)NC1CCCN(c2ncccn2)C1)C1CC1
InChIInChI=1S/C15H23N5O/c1-15(16,11-5-6-11)13(21)19-12-4-2-9-20(10-12)14-17-7-3-8-18-14/h3,7-8,11-12H,2,4-6,9-10,16H2,1H3,(H,19,21)
InChIKeyAQDWTRGRNQFQKM-UHFFFAOYSA-N
XLogP0.69
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 61265591
(2R)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119857933
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 79024327
3-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide;dihydrochloride
CID 120503187
N-[1-(5-fluoropyrimidin-2-yl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 163357522
N-[1-(5-chloropyrimidin-2-yl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 163357525
2-(aminomethyl)-3-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 65224744
N-cyclopropyl-2,2-dimethyl-3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 108957439
1-cyclobutyl-2-methyl-3-(1-pyrimidin-2-ylpiperidin-3-yl)guanidine;hydroiodide
CID 119153839
3-methylsulfanyl-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]propanamide
CID 42463878
4-acetyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]-1,4-diazepane-1-carboxamide
CID 94031653
3-methylsulfanyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]propanamide
CID 42463875

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide (CID 60866816) is 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide is CC(N)(C(=O)NC1CCCN(c2ncccn2)C1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide?
The InChIKey is AQDWTRGRNQFQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-15(16,11-5-6-11)13(21)19-12-4-2-9-20(10-12)14-17-7-3-8-18-14/h3,7-8,11-12H,2,4-6,9-10,16H2,1H3,(H,19,21).
What are the key properties of 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide?
2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide has a molecular weight of 289.38 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide is sourced from PubChem (CID 60866816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).