N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide

C16H25N3O — CID 113014760

IUPACN-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCC(C)(C)Nc1ccc(NC(=O)C2CCCCC2)cn1
InChIInChI=1S/C16H25N3O/c1-16(2,3)19-14-10-9-13(11-17-14)18-15(20)12-7-5-4-6-8-12/h9-12H,4-8H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyGMIVOHDQKZQEFN-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.81
Rot. Bonds3

About N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide

N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide (PubChem CID 113014760) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide
PubChem CID113014760
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCC(C)(C)Nc1ccc(NC(=O)C2CCCCC2)cn1
InChIInChI=1S/C16H25N3O/c1-16(2,3)19-14-10-9-13(11-17-14)18-15(20)12-7-5-4-6-8-12/h9-12H,4-8H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyGMIVOHDQKZQEFN-UHFFFAOYSA-N
XLogP3.81
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide 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

N-[6-(cyclopentylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113009854
N-[6-(butanoylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 1452761
N-[6-(3-methylbutylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113015064
N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113010320
N-[6-(4-chloroanilino)-3-pyridinyl]cyclohexanecarboxamide
CID 113018586
N-[5-(butylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 113023958
N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]cyclohexanecarboxamide
CID 113012101
N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]cyclobutanecarboxamide
CID 113010772
N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
CID 113009028
N-[6-[(2-cycloheptyloxyacetyl)amino]-3-pyridinyl]cyclobutanecarboxamide
CID 166280251
N-[5-(4-chloroanilino)-2-pyridinyl]cyclohexanecarboxamide
CID 113033361
N-[6-(4-propan-2-ylanilino)-3-pyridinyl]cyclobutanecarboxamide
CID 113017854

Frequently Asked Questions

What is the IUPAC name of N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide?
The IUPAC name of N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide (CID 113014760) is N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide?
The canonical SMILES for N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide is CC(C)(C)Nc1ccc(NC(=O)C2CCCCC2)cn1.
What is the InChIKey of N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide?
The InChIKey is GMIVOHDQKZQEFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-16(2,3)19-14-10-9-13(11-17-14)18-15(20)12-7-5-4-6-8-12/h9-12H,4-8H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide?
N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide is sourced from PubChem (CID 113014760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).