N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide

C14H21N3O — CID 114109624

IUPACN-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide
SMILESCCC1(CNC(=O)c2cnccc2NC)CCC1
InChIInChI=1S/C14H21N3O/c1-3-14(6-4-7-14)10-17-13(18)11-9-16-8-5-12(11)15-2/h5,8-9H,3-4,6-7,10H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyFWMFPYANMHTKDO-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.43
Rot. Bonds5

About N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide

N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide (PubChem CID 114109624) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide
PubChem CID114109624
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide
SMILESCCC1(CNC(=O)c2cnccc2NC)CCC1
InChIInChI=1S/C14H21N3O/c1-3-14(6-4-7-14)10-17-13(18)11-9-16-8-5-12(11)15-2/h5,8-9H,3-4,6-7,10H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyFWMFPYANMHTKDO-UHFFFAOYSA-N
XLogP2.43
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methylamino)-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 105070730
N-[(1-ethylcyclobutyl)methyl]-2-(methylamino)-5-nitrobenzamide
CID 103741365
2-amino-N-[(1-ethylcyclobutyl)methyl]benzamide
CID 103822063
N-[(2-ethylphenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 81245012
N-[[1-(bromomethyl)cyclohexyl]methyl]-3-chloropyridine-4-carboxamide
CID 103969750
4-(methylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 81242442
N-(2,3-dimethylbutyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245145
3-fluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 115362736
3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 81443017
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methoxypyridine-4-carboxamide
CID 105063923
2-amino-N-[(1-ethylcyclobutyl)methyl]-5-hydroxybenzamide
CID 114107082
3-chloro-N-[[1-(chloromethyl)cyclohexyl]methyl]pyridine-4-carboxamide
CID 113359928

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide (CID 114109624) is N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide is CCC1(CNC(=O)c2cnccc2NC)CCC1.
What is the InChIKey of N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is FWMFPYANMHTKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-14(6-4-7-14)10-17-13(18)11-9-16-8-5-12(11)15-2/h5,8-9H,3-4,6-7,10H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide?
N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 114109624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).