N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

C16H26N4O3S — CID 15998160

IUPACN-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide
SMILESO=C(NC1CCCCCC1)C1CCN(S(=O)(=O)c2cnc[nH]2)CC1
InChIInChI=1S/C16H26N4O3S/c21-16(19-14-5-3-1-2-4-6-14)13-7-9-20(10-8-13)24(22,23)15-11-17-12-18-15/h11-14H,1-10H2,(H,17,18)(H,19,21)
InChIKeyAQFRYQWPKNRLTP-UHFFFAOYSA-N
MW354.48 g/mol
LogP1.65
Rot. Bonds4

About N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide (PubChem CID 15998160) has the molecular formula C16H26N4O3S and a molecular weight of 354.48 g/mol. Its IUPAC name is N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide
PubChem CID15998160
Molecular FormulaC16H26N4O3S
Molecular Weight354.48 g/mol
Exact Mass354.17
IUPAC NameN-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide
SMILESO=C(NC1CCCCCC1)C1CCN(S(=O)(=O)c2cnc[nH]2)CC1
InChIInChI=1S/C16H26N4O3S/c21-16(19-14-5-3-1-2-4-6-14)13-7-9-20(10-8-13)24(22,23)15-11-17-12-18-15/h11-14H,1-10H2,(H,17,18)(H,19,21)
InChIKeyAQFRYQWPKNRLTP-UHFFFAOYSA-N
XLogP1.65
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide?
The IUPAC name of N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide (CID 15998160) is N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide?
The canonical SMILES for N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide is O=C(NC1CCCCCC1)C1CCN(S(=O)(=O)c2cnc[nH]2)CC1.
What is the InChIKey of N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide?
The InChIKey is AQFRYQWPKNRLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O3S/c21-16(19-14-5-3-1-2-4-6-14)13-7-9-20(10-8-13)24(22,23)15-11-17-12-18-15/h11-14H,1-10H2,(H,17,18)(H,19,21).
What are the key properties of N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide?
N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide has a molecular weight of 354.48 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide is sourced from PubChem (CID 15998160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).