(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide

C14H19N5O3S — CID 95140759

IUPAC(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide
SMILESN#Cc1ccc(NC(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)cc1
InChIInChI=1S/C14H19N5O3S/c15-8-11-3-5-13(6-4-11)18-14(20)19-7-1-2-12(10-19)9-17-23(16,21)22/h3-6,12,17H,1-2,7,9-10H2,(H,18,20)(H2,16,21,22)/t12-/m1/s1
InChIKeyGAOQRFIERHFEAU-GFCCVEGCSA-N
MW337.41 g/mol
LogP0.60
Rot. Bonds4

About (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide

(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide (PubChem CID 95140759) has the molecular formula C14H19N5O3S and a molecular weight of 337.41 g/mol. Its IUPAC name is (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide
PubChem CID95140759
Molecular FormulaC14H19N5O3S
Molecular Weight337.41 g/mol
Exact Mass337.12
IUPAC Name(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide
SMILESN#Cc1ccc(NC(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)cc1
InChIInChI=1S/C14H19N5O3S/c15-8-11-3-5-13(6-4-11)18-14(20)19-7-1-2-12(10-19)9-17-23(16,21)22/h3-6,12,17H,1-2,7,9-10H2,(H,18,20)(H2,16,21,22)/t12-/m1/s1
InChIKeyGAOQRFIERHFEAU-GFCCVEGCSA-N
XLogP0.60
TPSA128.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.41
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-(4-cyanophenyl)-3-(methanesulfonamidomethyl)piperidine-1-carboxamide
CID 94139251
(3S)-3-amino-N-(4-cyanophenyl)pyrrolidine-1-carboxamide
CID 113282408
1-N-(4-cyanophenyl)-4-N-(cyclopropylmethyl)-1,4-diazepane-1,4-dicarboxamide
CID 23852889
N-(4-cyanophenyl)piperidine-1-carboxamide
CID 89462027
1-(2-cyclobutylacetyl)-3-[(sulfamoylamino)methyl]piperidine
CID 113244692
phenyl 3-[(sulfamoylamino)methyl]piperidine-1-carboxylate
CID 61132158
1-but-2-ynoyl-3-[(sulfamoylamino)methyl]piperidine
CID 107992574
1-(2-aminopropanoyl)-3-[(sulfamoylamino)methyl]piperidine
CID 54873272
2-amino-N-[2-oxo-2-[3-[(sulfamoylamino)methyl]piperidin-1-yl]ethyl]acetamide
CID 60963858
(3R)-3-(methanesulfonamidomethyl)-N-(6-methoxy-3-pyridinyl)piperidine-1-carboxamide
CID 94031810
1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine
CID 115426454
1-(2-amino-2-thiophen-2-ylacetyl)-3-[(sulfamoylamino)methyl]piperidine
CID 115286723

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide?
The IUPAC name of (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide (CID 95140759) is (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide.
What is the SMILES notation for (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide?
The canonical SMILES for (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide is N#Cc1ccc(NC(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)cc1.
What is the InChIKey of (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide?
The InChIKey is GAOQRFIERHFEAU-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19N5O3S/c15-8-11-3-5-13(6-4-11)18-14(20)19-7-1-2-12(10-19)9-17-23(16,21)22/h3-6,12,17H,1-2,7,9-10H2,(H,18,20)(H2,16,21,22)/t12-/m1/s1.
What are the key properties of (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide?
(3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide has a molecular weight of 337.41 g/mol, XLogP of 0.60, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(4-cyanophenyl)-3-[(sulfamoylamino)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 95140759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).