3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide

C15H23N3O2 — CID 105071069

IUPAC3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)NC1CCCCCC1O
InChIInChI=1S/C15H23N3O2/c1-2-17-13-10-16-9-8-11(13)15(20)18-12-6-4-3-5-7-14(12)19/h8-10,12,14,17,19H,2-7H2,1H3,(H,18,20)
InChIKeyGXTLLAAYEGMWJE-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.94
Rot. Bonds4

About 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide

3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide (PubChem CID 105071069) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide
PubChem CID105071069
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)NC1CCCCCC1O
InChIInChI=1S/C15H23N3O2/c1-2-17-13-10-16-9-8-11(13)15(20)18-12-6-4-3-5-7-14(12)19/h8-10,12,14,17,19H,2-7H2,1H3,(H,18,20)
InChIKeyGXTLLAAYEGMWJE-UHFFFAOYSA-N
XLogP1.94
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-3-(ethylamino)pyridine-4-carboxamide
CID 105068169
N-(2,4-dimethylcyclohexyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070253
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
3-fluoro-N-(2-hydroxycyclohexyl)pyridine-4-carboxamide
CID 64950714
N-[(1R,2R)-2-hydroxycyclohexyl]-3-methoxypyridine-4-carboxamide
CID 102739207
3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide
CID 105070514
3-(ethylamino)-N-(6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 105070144
N-(2,3-dimethylcyclohexyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236631
3-(ethylamino)-N-(1-ethylpiperidin-3-yl)pyridine-4-carboxamide
CID 105069157
3-(ethylamino)-N-piperidin-1-ylpyridine-4-carboxamide
CID 105070981
3-(4-bromo-2-chloroanilino)-N-[(1R,2R)-2-hydroxycyclohexyl]pyridine-4-carboxamide
CID 118486060
3-(methylamino)-N-(2-propan-2-ylcyclohexyl)pyridine-4-carboxamide
CID 105070917

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide?
The IUPAC name of 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide (CID 105071069) is 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide?
The canonical SMILES for 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide is CCNc1cnccc1C(=O)NC1CCCCCC1O.
What is the InChIKey of 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide?
The InChIKey is GXTLLAAYEGMWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-2-17-13-10-16-9-8-11(13)15(20)18-12-6-4-3-5-7-14(12)19/h8-10,12,14,17,19H,2-7H2,1H3,(H,18,20).
What are the key properties of 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide?
3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.94, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide is sourced from PubChem (CID 105071069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).