5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide

C19H27N5O — CID 109285075

IUPAC5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(N(C)CCc2ccncc2)cn1
InChIInChI=1S/C19H27N5O/c1-4-11-24(12-5-2)19(25)17-14-22-18(15-21-17)23(3)13-8-16-6-9-20-10-7-16/h6-7,9-10,14-15H,4-5,8,11-13H2,1-3H3
InChIKeyRVHWAMSTWXVBFW-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.81
Rot. Bonds9

About 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide

5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide (PubChem CID 109285075) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide
PubChem CID109285075
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(N(C)CCc2ccncc2)cn1
InChIInChI=1S/C19H27N5O/c1-4-11-24(12-5-2)19(25)17-14-22-18(15-21-17)23(3)13-8-16-6-9-20-10-7-16/h6-7,9-10,14-15H,4-5,8,11-13H2,1-3H3
InChIKeyRVHWAMSTWXVBFW-UHFFFAOYSA-N
XLogP2.81
TPSA62.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-N-methyl-5-[methyl(2-pyridin-4-ylethyl)amino]pyrazine-2-carboxamide
CID 109285072
5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyridine-2-carboxamide
CID 109192958
4-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyridine-2-carboxamide
CID 109214742
N-tert-butyl-5-[methyl(2-pyridin-4-ylethyl)amino]pyrazine-2-carboxamide
CID 109285067
N-(3-acetamidophenyl)-5-[methyl(2-pyridin-4-ylethyl)amino]pyrazine-2-carboxamide
CID 109285128
N-(3-chloro-4-methylphenyl)-5-[methyl(2-pyridin-4-ylethyl)amino]pyrazine-2-carboxamide
CID 109285110
5-(chloromethyl)-N-methyl-N-(2-pyridin-4-ylethyl)pyrazin-2-amine
CID 107373359
5-(N-ethylanilino)-N,N-dipropylpyrazine-2-carboxamide
CID 109288920
2-(dipropylamino)-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-4-carboxamide
CID 109309038
N-[2-(dimethylamino)ethyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109153874
5-(aminomethyl)-N,N-dipropylpyridine-2-carboxamide
CID 55229815
N-methyl-5-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 62284014

Frequently Asked Questions

What is the IUPAC name of 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide?
The IUPAC name of 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide (CID 109285075) is 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide.
What is the SMILES notation for 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide?
The canonical SMILES for 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide is CCCN(CCC)C(=O)c1cnc(N(C)CCc2ccncc2)cn1.
What is the InChIKey of 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide?
The InChIKey is RVHWAMSTWXVBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-4-11-24(12-5-2)19(25)17-14-22-18(15-21-17)23(3)13-8-16-6-9-20-10-7-16/h6-7,9-10,14-15H,4-5,8,11-13H2,1-3H3.
What are the key properties of 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide?
5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 2.81, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyrazine-2-carboxamide is sourced from PubChem (CID 109285075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).