N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide

C10H14ClN3O — CID 130770747

IUPACN-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide
SMILESCN(C)CCC(=O)Nc1cc(Cl)ccn1
InChIInChI=1S/C10H14ClN3O/c1-14(2)6-4-10(15)13-9-7-8(11)3-5-12-9/h3,5,7H,4,6H2,1-2H3,(H,12,13,15)
InChIKeyCAUOSZVACHIFNE-UHFFFAOYSA-N
MW227.70 g/mol
LogP1.63
Rot. Bonds4

About N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide

N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide (PubChem CID 130770747) has the molecular formula C10H14ClN3O and a molecular weight of 227.70 g/mol. Its IUPAC name is N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide.

Molecular Properties

Compound NameN-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide
PubChem CID130770747
Molecular FormulaC10H14ClN3O
Molecular Weight227.70 g/mol
Exact Mass227.08
IUPAC NameN-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide
SMILESCN(C)CCC(=O)Nc1cc(Cl)ccn1
InChIInChI=1S/C10H14ClN3O/c1-14(2)6-4-10(15)13-9-7-8(11)3-5-12-9/h3,5,7H,4,6H2,1-2H3,(H,12,13,15)
InChIKeyCAUOSZVACHIFNE-UHFFFAOYSA-N
XLogP1.63
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.70
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-amino-2-pyridinyl)-3-(dimethylamino)propanamide
CID 162441543
N-(4-chloro-2-pyridinyl)-2-hydroxyacetamide
CID 83768276
N-(4-chloro-2-pyridinyl)-3-ethoxypropanamide
CID 115626770
N-(4-chloro-2-pyridinyl)-4-methoxypent-4-enamide
CID 123816507
N-(4-chloro-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 115626697
N-(4-chloro-2-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115968525
N-(4-chloro-2-pyridinyl)-3-methylpentanamide
CID 114877777
N-(4-chloro-2-pyridinyl)-2-methylbutanamide
CID 115626778
N-(4-chloro-2-pyridinyl)-3-imidazol-1-ylpropanamide
CID 115627274
N-(4-chloro-2-pyridinyl)-3-[cyclopropyl-[2-(2,5-dimethylanilino)-2-oxoethyl]amino]propanamide
CID 84568196
N-(4-chloro-2-pyridinyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 108796358
N-[4-[7-(5-chloro-2-fluorophenyl)-2,3-dihydropyrido[3,4-b][1,4]oxazin-1-yl]-2-pyridinyl]-3-(dimethylamino)propanamide
CID 171419239

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide?
The IUPAC name of N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide (CID 130770747) is N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide.
What is the SMILES notation for N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide?
The canonical SMILES for N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide is CN(C)CCC(=O)Nc1cc(Cl)ccn1.
What is the InChIKey of N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide?
The InChIKey is CAUOSZVACHIFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c1-14(2)6-4-10(15)13-9-7-8(11)3-5-12-9/h3,5,7H,4,6H2,1-2H3,(H,12,13,15).
What are the key properties of N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide?
N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide has a molecular weight of 227.70 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-pyridinyl)-3-(dimethylamino)propanamide is sourced from PubChem (CID 130770747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).