(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide

C14H26N4O2 — CID 94192168

IUPAC(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide
SMILESNC(=O)NC[C@H]1CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C14H26N4O2/c15-13(19)16-9-11-5-4-8-18(10-11)14(20)17-12-6-2-1-3-7-12/h11-12H,1-10H2,(H,17,20)(H3,15,16,19)/t11-/m1/s1
InChIKeyMEDWGFIJUKLSQA-LLVKDONJSA-N
MW282.39 g/mol
LogP1.41
Rot. Bonds3

About (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide

(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide (PubChem CID 94192168) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide
PubChem CID94192168
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide
SMILESNC(=O)NC[C@H]1CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C14H26N4O2/c15-13(19)16-9-11-5-4-8-18(10-11)14(20)17-12-6-2-1-3-7-12/h11-12H,1-10H2,(H,17,20)(H3,15,16,19)/t11-/m1/s1
InChIKeyMEDWGFIJUKLSQA-LLVKDONJSA-N
XLogP1.41
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-cyclooctyl-3-(hydroxymethyl)piperidine-1-carboxamide
CID 95577956
2-[1-(cyclohexylcarbamoyl)piperidin-3-yl]acetic acid
CID 62690079
3-(aminomethyl)-N-cyclobutylpiperidine-1-carboxamide
CID 82508340
[1-(2-bromo-2-methylpropanoyl)piperidin-3-yl]methylurea
CID 114328264
3-(aminomethyl)-N-cyclohexylpyrrolidine-1-carboxamide
CID 62061626
(3R)-3-amino-N-cyclopentylpyrrolidine-1-carboxamide
CID 115301653
[1-[3-(cyclopropylamino)propanoyl]piperidin-3-yl]methylurea
CID 54873222
3-[3-(aminomethyl)pyrrolidine-1-carbonyl]-N-cyclopentylpiperidine-1-carboxamide
CID 119483653
3-[1-(cyclobutylcarbamoyl)piperidin-3-yl]propanoic acid
CID 62414233
[1-[(2R)-2-amino-3-methylbutanoyl]piperidin-3-yl]methylurea
CID 79013238
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
[1-(1,3-thiazole-4-carbonyl)piperidin-3-yl]methylurea
CID 55142865

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide?
The IUPAC name of (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide (CID 94192168) is (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide.
What is the SMILES notation for (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide?
The canonical SMILES for (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide is NC(=O)NC[C@H]1CCCN(C(=O)NC2CCCCC2)C1.
What is the InChIKey of (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide?
The InChIKey is MEDWGFIJUKLSQA-LLVKDONJSA-N. The full InChI is InChI=1S/C14H26N4O2/c15-13(19)16-9-11-5-4-8-18(10-11)14(20)17-12-6-2-1-3-7-12/h11-12H,1-10H2,(H,17,20)(H3,15,16,19)/t11-/m1/s1.
What are the key properties of (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide?
(3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide has a molecular weight of 282.39 g/mol, XLogP of 1.41, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(carbamoylamino)methyl]-N-cyclohexylpiperidine-1-carboxamide is sourced from PubChem (CID 94192168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).