N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide

C13H19N3O — CID 62167949

IUPACN-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)NCC2CCC2)c1
InChIInChI=1S/C13H19N3O/c1-2-14-11-6-7-15-12(8-11)13(17)16-9-10-4-3-5-10/h6-8,10H,2-5,9H2,1H3,(H,14,15)(H,16,17)
InChIKeyPLCQHBUUXVAMSI-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.04
Rot. Bonds5

About N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide

N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide (PubChem CID 62167949) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
PubChem CID62167949
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)NCC2CCC2)c1
InChIInChI=1S/C13H19N3O/c1-2-14-11-6-7-15-12(8-11)13(17)16-9-10-4-3-5-10/h6-8,10H,2-5,9H2,1H3,(H,14,15)(H,16,17)
InChIKeyPLCQHBUUXVAMSI-UHFFFAOYSA-N
XLogP2.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
N-(cyclohexylmethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62169507
4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62173174
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612
N-[2-[cyclopropyl(methyl)amino]ethyl]-4-(ethylamino)pyridine-2-carboxamide
CID 62978567
N-ethyl-4-[(3-hydroxycyclobutyl)methylamino]pyridine-2-carboxamide
CID 66004621
4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43517479
4-(cycloheptylamino)-N-ethylpyridine-2-carboxamide
CID 43517906
4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
CID 43517873
N-benzyl-4-(ethylamino)pyridine-2-carboxamide
CID 55042680
4-(ethylamino)-N-(2-methylsulfanylethyl)pyridine-2-carboxamide
CID 63963789
N-butan-2-yl-4-(ethylamino)pyridine-2-carboxamide
CID 62171647

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide (CID 62167949) is N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide is CCNc1ccnc(C(=O)NCC2CCC2)c1.
What is the InChIKey of N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide?
The InChIKey is PLCQHBUUXVAMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-14-11-6-7-15-12(8-11)13(17)16-9-10-4-3-5-10/h6-8,10H,2-5,9H2,1H3,(H,14,15)(H,16,17).
What are the key properties of N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide?
N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62167949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).