N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide

C15H22N2OS — CID 116654649

IUPACN-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)N(Cc2cccs2)C2CC2)C1
InChIInChI=1S/C15H22N2OS/c1-12-4-2-8-16(10-12)15(18)17(13-6-7-13)11-14-5-3-9-19-14/h3,5,9,12-13H,2,4,6-8,10-11H2,1H3
InChIKeyCPCYOIQLSPLAGK-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.56
Rot. Bonds3

About N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide

N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide (PubChem CID 116654649) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide
PubChem CID116654649
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC NameN-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)N(Cc2cccs2)C2CC2)C1
InChIInChI=1S/C15H22N2OS/c1-12-4-2-8-16(10-12)15(18)17(13-6-7-13)11-14-5-3-9-19-14/h3,5,9,12-13H,2,4,6-8,10-11H2,1H3
InChIKeyCPCYOIQLSPLAGK-UHFFFAOYSA-N
XLogP3.56
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-[cyclopropyl(thiophen-2-ylmethyl)carbamoyl]piperidine-3-carboxylic acid
CID 81117787
1-[cyclopropyl(thiophen-2-ylmethyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63030379
1-[propan-2-yl(thiophen-2-ylmethyl)carbamoyl]piperidine-3-carboxylic acid
CID 61455664
N-cyclopropyl-2-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 78852309
4-[cyclopropyl(thiophen-2-ylmethyl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 76992646
N-cyclopropyl-3-methyl-N-(2-methylpropyl)piperidine-1-carboxamide
CID 116654963
(2S)-2-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)pentanamide
CID 93369625
3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide
CID 11142038
N',3-dimethyl-N-(thiophen-2-ylmethyl)piperidine-1-carboximidamide
CID 111144338
(2S,4S)-1-[cyclopropyl(thiophen-2-ylmethyl)carbamoyl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 64712203
3-amino-N-cyclopropyl-2,2,3-trimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 65269853
1-[(4S)-4-(dimethylamino)azepan-1-yl]-3-thiophen-2-ylpropan-1-one
CID 95726421

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide (CID 116654649) is N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide is CC1CCCN(C(=O)N(Cc2cccs2)C2CC2)C1.
What is the InChIKey of N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide?
The InChIKey is CPCYOIQLSPLAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-12-4-2-8-16(10-12)15(18)17(13-6-7-13)11-14-5-3-9-19-14/h3,5,9,12-13H,2,4,6-8,10-11H2,1H3.
What are the key properties of N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide?
N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide has a molecular weight of 278.42 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 116654649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).