3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide

C12H19N3O — CID 105068562

IUPAC3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide
SMILESCCCN(C)C(=O)c1ccncc1NCC
InChIInChI=1S/C12H19N3O/c1-4-8-15(3)12(16)10-6-7-13-9-11(10)14-5-2/h6-7,9,14H,4-5,8H2,1-3H3
InChIKeyMQLAZZQUJNLUCG-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.00
Rot. Bonds5

About 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide

3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide (PubChem CID 105068562) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide
PubChem CID105068562
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide
SMILESCCCN(C)C(=O)c1ccncc1NCC
InChIInChI=1S/C12H19N3O/c1-4-8-15(3)12(16)10-6-7-13-9-11(10)14-5-2/h6-7,9,14H,4-5,8H2,1-3H3
InChIKeyMQLAZZQUJNLUCG-UHFFFAOYSA-N
XLogP2.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-hydroxypentyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 107201068
N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105069961
N-[(4-chlorophenyl)methyl]-3-(ethylamino)-N-methylpyridine-4-carboxamide
CID 105069615
N-(2-cyanoethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068056
N-(3-hydroxybutyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071302
3-(ethylamino)-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyridine-4-carboxamide
CID 105071494
3-(ethylamino)-N-(4-fluorophenyl)-N-methylpyridine-4-carboxamide
CID 105069144
N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068880
N-butyl-N,3-dimethylpyridine-4-carboxamide
CID 110855737
4-(ethylamino)-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 81242281
4-(ethylamino)-N-methyl-N-(3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 114238290
3-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 105069188

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide?
The IUPAC name of 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide (CID 105068562) is 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide.
What is the SMILES notation for 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide?
The canonical SMILES for 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide is CCCN(C)C(=O)c1ccncc1NCC.
What is the InChIKey of 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide?
The InChIKey is MQLAZZQUJNLUCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-8-15(3)12(16)10-6-7-13-9-11(10)14-5-2/h6-7,9,14H,4-5,8H2,1-3H3.
What are the key properties of 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide?
3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide is sourced from PubChem (CID 105068562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).