3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide

C16H25N3O — CID 104741168

IUPAC3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide
SMILESCC(C)(C)C1CCCCC1NC(=O)c1ncccc1N
InChIInChI=1S/C16H25N3O/c1-16(2,3)11-7-4-5-9-13(11)19-15(20)14-12(17)8-6-10-18-14/h6,8,10-11,13H,4-5,7,9,17H2,1-3H3,(H,19,20)
InChIKeyWDUOTOUAXXNJMZ-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.00
Rot. Bonds2

About 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide

3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide (PubChem CID 104741168) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide
PubChem CID104741168
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide
SMILESCC(C)(C)C1CCCCC1NC(=O)c1ncccc1N
InChIInChI=1S/C16H25N3O/c1-16(2,3)11-7-4-5-9-13(11)19-15(20)14-12(17)8-6-10-18-14/h6,8,10-11,13H,4-5,7,9,17H2,1-3H3,(H,19,20)
InChIKeyWDUOTOUAXXNJMZ-UHFFFAOYSA-N
XLogP3.00
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(2-tert-butylcyclohexyl)-3-methylbenzamide
CID 43699383
3-amino-N-(3,4-dimethylcyclohexyl)pyridine-2-carboxamide
CID 113447750
3-amino-N-(1,1-dioxothian-4-yl)pyridine-2-carboxamide
CID 104741112
N-(2-tert-butylcyclohexyl)-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 55583530
3-amino-N-(2-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 113447702
methyl 2-[[3-(trifluoromethyl)pyridine-2-carbonyl]amino]cycloheptane-1-carboxylate
CID 75440536
N-[(1R,2S)-2-tert-butylcyclohexyl]furan-2-carboxamide
CID 27451326
3-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 104740792
N-(2-chlorocycloheptyl)-3-methylpyridine-2-carboxamide
CID 113395039
3-amino-N-(1-cyclopropylpiperidin-4-yl)pyridine-2-carboxamide
CID 104741372
3-amino-N-[(1-methylpiperidin-2-yl)methyl]pyridine-2-carboxamide
CID 113447691
2-(5-amino-2-pyridinyl)-N-(2-tert-butylcyclohexyl)acetamide;hydrochloride
CID 120621478

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide (CID 104741168) is 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide is CC(C)(C)C1CCCCC1NC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide?
The InChIKey is WDUOTOUAXXNJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-16(2,3)11-7-4-5-9-13(11)19-15(20)14-12(17)8-6-10-18-14/h6,8,10-11,13H,4-5,7,9,17H2,1-3H3,(H,19,20).
What are the key properties of 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide?
3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-tert-butylcyclohexyl)pyridine-2-carboxamide is sourced from PubChem (CID 104741168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).