4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide

C14H21N3O — CID 113234707

IUPAC4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(C)C2CC2)ccn1
InChIInChI=1S/C14H21N3O/c1-3-15-14(18)13-8-12(6-7-16-13)17-9-10(2)11-4-5-11/h6-8,10-11H,3-5,9H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyDIXCXXDBVKBBLX-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.29
Rot. Bonds6

About 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide

4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide (PubChem CID 113234707) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
PubChem CID113234707
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(C)C2CC2)ccn1
InChIInChI=1S/C14H21N3O/c1-3-15-14(18)13-8-12(6-7-16-13)17-9-10(2)11-4-5-11/h6-8,10-11H,3-5,9H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyDIXCXXDBVKBBLX-UHFFFAOYSA-N
XLogP2.29
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-cyclopropylpropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 115620851
4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
CID 107159414
4-(cycloheptylamino)-N-ethylpyridine-2-carboxamide
CID 43517906
4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
CID 43517873
N-ethyl-4-[(3-hydroxycyclobutyl)methylamino]pyridine-2-carboxamide
CID 66004621
4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 43517863
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
N-ethyl-4-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-2-carboxamide
CID 79358278
N-ethyl-4-[[(2S,3S)-2-hydroxy-2,3-dimethylpentyl]amino]pyridine-2-carboxamide
CID 97212779
4-[2-[cyclopropyl(ethyl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 103739556
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 62142219
N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
CID 62167949

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide (CID 113234707) is 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(NCC(C)C2CC2)ccn1.
What is the InChIKey of 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide?
The InChIKey is DIXCXXDBVKBBLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-15-14(18)13-8-12(6-7-16-13)17-9-10(2)11-4-5-11/h6-8,10-11H,3-5,9H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide?
4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 113234707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).