1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide

C17H25N3O2S — CID 94175624

IUPAC1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)N[C@@H](c2cccs2)C2CCCC2)CC1
InChIInChI=1S/C17H25N3O2S/c18-16(21)13-7-9-20(10-8-13)17(22)19-15(12-4-1-2-5-12)14-6-3-11-23-14/h3,6,11-13,15H,1-2,4-5,7-10H2,(H2,18,21)(H,19,22)/t15-/m1/s1
InChIKeyQRNLOSCOUXVZSQ-OAHLLOKOSA-N
MW335.47 g/mol
LogP2.89
Rot. Bonds4

About 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide

1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide (PubChem CID 94175624) has the molecular formula C17H25N3O2S and a molecular weight of 335.47 g/mol. Its IUPAC name is 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide
PubChem CID94175624
Molecular FormulaC17H25N3O2S
Molecular Weight335.47 g/mol
Exact Mass335.17
IUPAC Name1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)N[C@@H](c2cccs2)C2CCCC2)CC1
InChIInChI=1S/C17H25N3O2S/c18-16(21)13-7-9-20(10-8-13)17(22)19-15(12-4-1-2-5-12)14-6-3-11-23-14/h3,6,11-13,15H,1-2,4-5,7-10H2,(H2,18,21)(H,19,22)/t15-/m1/s1
InChIKeyQRNLOSCOUXVZSQ-OAHLLOKOSA-N
XLogP2.89
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.47
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-[cyclopentyl(thiophen-2-yl)methyl]-4-N-(1,3,4-thiadiazol-2-yl)piperidine-1,4-dicarboxamide
CID 55930277
1-N-[(S)-cyclopentyl-(2-fluorophenyl)methyl]piperidine-1,4-dicarboxamide
CID 97055835
(3R)-3-acetamido-N-[(S)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1-carboxamide
CID 97098464
(3R)-1-N-[(R)-cyclohexyl(phenyl)methyl]pyrrolidine-1,3-dicarboxamide
CID 94118979
(3S)-1-N-[(S)-cyclohexyl(phenyl)methyl]pyrrolidine-1,3-dicarboxamide
CID 94118978
N-[(R)-cyclopentyl(thiophen-2-yl)methyl]thiophene-2-carboxamide
CID 39032304
N-[(S)-cyclopentyl(thiophen-2-yl)methyl]-1-(pyridine-3-carbonyl)piperidine-4-carboxamide
CID 39613287
1-[(R)-cyclopentyl(thiophen-2-yl)methyl]-3-methylurea
CID 94152755
4-(carbamoylamino)-N-[(S)-cyclopentyl(thiophen-2-yl)methyl]benzamide
CID 51943755
N-[cyclopentyl(thiophen-2-yl)methyl]piperidine-4-carboxamide
CID 43697912
2-(cyclopentylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 60847966
3-[[cyclopentyl(thiophen-2-yl)methyl]amino]-2-hydroxypropanamide
CID 114153572

Frequently Asked Questions

What is the IUPAC name of 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide (CID 94175624) is 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide is NC(=O)C1CCN(C(=O)N[C@@H](c2cccs2)C2CCCC2)CC1.
What is the InChIKey of 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide?
The InChIKey is QRNLOSCOUXVZSQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H25N3O2S/c18-16(21)13-7-9-20(10-8-13)17(22)19-15(12-4-1-2-5-12)14-6-3-11-23-14/h3,6,11-13,15H,1-2,4-5,7-10H2,(H2,18,21)(H,19,22)/t15-/m1/s1.
What are the key properties of 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide?
1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide has a molecular weight of 335.47 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[(R)-cyclopentyl(thiophen-2-yl)methyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 94175624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).