5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide

C14H21N3O — CID 63723531

IUPAC5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(CN)cn1)C1CCCC1
InChIInChI=1S/C14H21N3O/c1-2-17(12-5-3-4-6-12)14(18)13-8-7-11(9-15)10-16-13/h7-8,10,12H,2-6,9,15H2,1H3
InChIKeyKOWVMMBOKFEDGA-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.95
Rot. Bonds4

About 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide

5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide (PubChem CID 63723531) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
PubChem CID63723531
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(CN)cn1)C1CCCC1
InChIInChI=1S/C14H21N3O/c1-2-17(12-5-3-4-6-12)14(18)13-8-7-11(9-15)10-16-13/h7-8,10,12H,2-6,9,15H2,1H3
InChIKeyKOWVMMBOKFEDGA-UHFFFAOYSA-N
XLogP1.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aminomethyl)-N-(cyclobutylmethyl)-N-ethylpyridine-2-carboxamide
CID 107396959
5-(aminomethyl)-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 63723702
5-(3-aminoprop-1-ynyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
CID 62953663
3-[6-[cyclopentyl(ethyl)carbamoyl]-3-pyridinyl]prop-2-enoic acid
CID 76978678
5-[cyclohexyl(ethyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120684743
5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide
CID 62953692
5-(aminomethyl)-N,N-dipropylpyridine-2-carboxamide
CID 55229815
5-(aminomethyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 79384484
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
CID 104639321
N-(4-aminocyclohexyl)-5-chloro-N-ethylpyridine-2-carboxamide
CID 79115416
[5-(aminomethyl)-2-pyridinyl]-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 63724060
5-(aminomethyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-ethylpyridine-2-carboxamide
CID 63724556

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide (CID 63723531) is 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide is CCN(C(=O)c1ccc(CN)cn1)C1CCCC1.
What is the InChIKey of 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide?
The InChIKey is KOWVMMBOKFEDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-17(12-5-3-4-6-12)14(18)13-8-7-11(9-15)10-16-13/h7-8,10,12H,2-6,9,15H2,1H3.
What are the key properties of 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide?
5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 63723531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).