N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide

C18H28N4O3S — CID 10385136

IUPACN-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide
SMILESO=C(NS(=O)(=O)c1cnccc1NC1CCCCCC1)N1CCCCC1
InChIInChI=1S/C18H28N4O3S/c23-18(22-12-6-3-7-13-22)21-26(24,25)17-14-19-11-10-16(17)20-15-8-4-1-2-5-9-15/h10-11,14-15H,1-9,12-13H2,(H,19,20)(H,21,23)
InChIKeyPRGISWGULNLCKV-UHFFFAOYSA-N
MW380.51 g/mol
LogP3.10
Rot. Bonds4

About N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide

N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide (PubChem CID 10385136) has the molecular formula C18H28N4O3S and a molecular weight of 380.51 g/mol. Its IUPAC name is N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide
PubChem CID10385136
Molecular FormulaC18H28N4O3S
Molecular Weight380.51 g/mol
Exact Mass380.19
IUPAC NameN-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide
SMILESO=C(NS(=O)(=O)c1cnccc1NC1CCCCCC1)N1CCCCC1
InChIInChI=1S/C18H28N4O3S/c23-18(22-12-6-3-7-13-22)21-26(24,25)17-14-19-11-10-16(17)20-15-8-4-1-2-5-9-15/h10-11,14-15H,1-9,12-13H2,(H,19,20)(H,21,23)
InChIKeyPRGISWGULNLCKV-UHFFFAOYSA-N
XLogP3.10
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.51
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]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

[4-(cyclooctylamino)-3-pyridinyl]sulfonylcarbamodithioic acid
CID 10044029
1-[[4-(cyclooctylamino)-3-pyridinyl]sulfonyl]-3-ethylthiourea
CID 3025730
N-cyano-N'-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboximidamide
CID 10408953
4-(cycloheptylamino)pyridine-3-carboxylic acid
CID 81232550
1-cyano-3-[[4-(cyclopentylamino)-3-pyridinyl]sulfonyl]-2-propan-2-ylguanidine
CID 10247317
4-(cyclopentylamino)-N-[2-nitro-1-(propan-2-ylamino)ethenyl]pyridine-3-sulfonamide
CID 23238854
4-(cyclobutylamino)pyridine-3-carboxylic acid
CID 81243809
N-(3-fluoro-4-pyridinyl)pyrrolidine-1-carboxamide
CID 103886195
4-chloro-N-cyclohexylpyridine-3-sulfonamide
CID 10492602
4-[(3-amino-4-pyridinyl)amino]piperidine-1-carboxylic acid
CID 143481512
4-chloro-N-cyclooctylpyridin-3-amine
CID 83166915
tert-butyl 4-[(4-methyl-3-pyridinyl)amino]azepane-1-carboxylate
CID 103982125

Frequently Asked Questions

What is the IUPAC name of N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide?
The IUPAC name of N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide (CID 10385136) is N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide?
The canonical SMILES for N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide is O=C(NS(=O)(=O)c1cnccc1NC1CCCCCC1)N1CCCCC1.
What is the InChIKey of N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide?
The InChIKey is PRGISWGULNLCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O3S/c23-18(22-12-6-3-7-13-22)21-26(24,25)17-14-19-11-10-16(17)20-15-8-4-1-2-5-9-15/h10-11,14-15H,1-9,12-13H2,(H,19,20)(H,21,23).
What are the key properties of N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide?
N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide has a molecular weight of 380.51 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(cycloheptylamino)-3-pyridinyl]sulfonyl]piperidine-1-carboxamide is sourced from PubChem (CID 10385136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).