1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid

C15H26N2O3 — CID 63124464

IUPAC1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid
SMILESCC(C(=O)NC1CCCC1)N1CCC(C)(C(=O)O)CC1
InChIInChI=1S/C15H26N2O3/c1-11(13(18)16-12-5-3-4-6-12)17-9-7-15(2,8-10-17)14(19)20/h11-12H,3-10H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyWUHQHUBOBAKCNY-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.62
Rot. Bonds4

About 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid

1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid (PubChem CID 63124464) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid
PubChem CID63124464
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid
SMILESCC(C(=O)NC1CCCC1)N1CCC(C)(C(=O)O)CC1
InChIInChI=1S/C15H26N2O3/c1-11(13(18)16-12-5-3-4-6-12)17-9-7-15(2,8-10-17)14(19)20/h11-12H,3-10H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyWUHQHUBOBAKCNY-UHFFFAOYSA-N
XLogP1.62
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-3-methylpiperidine-3-carboxylic acid
CID 63136783
N-cyclohexyl-2-[4-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 115305201
3-amino-1-[1-(cyclohexylamino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylic acid
CID 107324286
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
1-[1-(carbamoylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid
CID 63124488
N-cyclopropyl-2-[4-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 115305216
(2S)-N-cyclopentyl-2-[4-hydroxy-4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propanamide
CID 95129102
2-[4-(cyclohexylcarbamoylamino)piperidin-1-yl]-N-cyclopropylpropanamide
CID 60573199
4-methyl-1-[1-oxo-1-(pentan-2-ylamino)propan-2-yl]piperidine-4-carboxylic acid
CID 63124532
N-cyclopentyl-2-[4-(ethylamino)piperidin-1-yl]propanamide
CID 54923819
N-cyclopentyl-2-(4-methylsulfonylpiperazin-1-yl)propanamide
CID 51073855
N-cyclopentyl-2-(1,4-diazepan-1-yl)propanamide
CID 43115745

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid?
The IUPAC name of 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid (CID 63124464) is 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid is CC(C(=O)NC1CCCC1)N1CCC(C)(C(=O)O)CC1.
What is the InChIKey of 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid?
The InChIKey is WUHQHUBOBAKCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-11(13(18)16-12-5-3-4-6-12)17-9-7-15(2,8-10-17)14(19)20/h11-12H,3-10H2,1-2H3,(H,16,18)(H,19,20).
What are the key properties of 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid?
1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid has a molecular weight of 282.38 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-4-methylpiperidine-4-carboxylic acid is sourced from PubChem (CID 63124464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).