2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide

C18H29N3O — CID 120618487

IUPAC2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
SMILESCCC(C)(C)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1
InChIInChI=1S/C18H29N3O/c1-4-18(2,3)13-5-8-15(9-6-13)21-17(22)11-16-10-7-14(19)12-20-16/h7,10,12-13,15H,4-6,8-9,11,19H2,1-3H3,(H,21,22)
InChIKeyPCNAEOAPUORGLW-UHFFFAOYSA-N
MW303.45 g/mol
LogP3.32
Rot. Bonds5

About 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide

2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide (PubChem CID 120618487) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
PubChem CID120618487
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC Name2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
SMILESCCC(C)(C)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1
InChIInChI=1S/C18H29N3O/c1-4-18(2,3)13-5-8-15(9-6-13)21-17(22)11-16-10-7-14(19)12-20-16/h7,10,12-13,15H,4-6,8-9,11,19H2,1-3H3,(H,21,22)
InChIKeyPCNAEOAPUORGLW-UHFFFAOYSA-N
XLogP3.32
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
2-(5-amino-2-pyridinyl)-N-(2-cyclopropylpropan-2-yl)acetamide
CID 114094140
2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 120633539
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 120620773
2-(5-amino-2-pyridinyl)-N-cyclohex-3-en-1-ylacetamide
CID 107339064
2-(5-amino-2-pyridinyl)-N-(thiolan-3-yl)acetamide
CID 107339832
2-(5-amino-2-pyridinyl)-N-(2-tert-butylcyclohexyl)acetamide;hydrochloride
CID 120621478
2-(5-amino-2-pyridinyl)-N-tert-butylacetamide
CID 107337327
2-(5-amino-2-pyridinyl)-N-(3-ethyl-2-methylcyclopentyl)acetamide
CID 107338994
N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 16563691

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide (CID 120618487) is 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide is CCC(C)(C)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide?
The InChIKey is PCNAEOAPUORGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O/c1-4-18(2,3)13-5-8-15(9-6-13)21-17(22)11-16-10-7-14(19)12-20-16/h7,10,12-13,15H,4-6,8-9,11,19H2,1-3H3,(H,21,22).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide?
2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide has a molecular weight of 303.45 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide is sourced from PubChem (CID 120618487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).