N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide

C15H27N3O2 — CID 60853818

IUPACN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide
SMILESCC(C)NCCC(=O)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-11(2)16-8-5-14(19)17-13-6-9-18(10-7-13)15(20)12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyVAWJXPXOSLPJKI-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.89
Rot. Bonds6

About N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide (PubChem CID 60853818) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide
PubChem CID60853818
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide
SMILESCC(C)NCCC(=O)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-11(2)16-8-5-14(19)17-13-6-9-18(10-7-13)15(20)12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyVAWJXPXOSLPJKI-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[3-(propan-2-ylamino)propanoyl]piperidin-4-yl]propanamide
CID 54872195
2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
CID 60853761
N-[1-[4-(propan-2-ylamino)butanoyl]piperidin-4-yl]propanamide
CID 60947455
tert-butyl N-[3-[[1-(cyclopentanecarbonyl)piperidin-4-yl]amino]-3-oxopropyl]carbamate
CID 108919724
5-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]pentanamide
CID 43700730
2-chloro-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]acetamide
CID 50988896
N-cyclopropyl-4-[3-(propan-2-ylamino)propanoylamino]butanamide
CID 79401446
1-[1-(1-acetylpiperidine-4-carbonyl)piperidin-4-yl]-3-propan-2-ylurea
CID 110821926
N-[4-[[1-(cyclohexanecarbonyl)piperidin-4-yl]amino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 55706617
ethyl 4-[[1-(cyclohexanecarbonyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 108563869
N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
CID 114546265
N-(1-ethylsulfonylpiperidin-4-yl)-4-(propan-2-ylamino)butanamide
CID 61275650

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide?
The IUPAC name of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide (CID 60853818) is N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide.
What is the SMILES notation for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide?
The canonical SMILES for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide is CC(C)NCCC(=O)NC1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide?
The InChIKey is VAWJXPXOSLPJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-11(2)16-8-5-14(19)17-13-6-9-18(10-7-13)15(20)12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H,17,19).
What are the key properties of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide?
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide has a molecular weight of 281.40 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(propan-2-ylamino)propanamide is sourced from PubChem (CID 60853818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).