N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine

C15H20N4 — CID 62771736

IUPACN-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1cnc(-c2ccncc2)nc1C
InChIInChI=1S/C15H20N4/c1-4-7-17-11(2)14-10-18-15(19-12(14)3)13-5-8-16-9-6-13/h5-6,8-11,17H,4,7H2,1-3H3
InChIKeyDYZQJNKRLHNLNH-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.91
Rot. Bonds5

About N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine

N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine (PubChem CID 62771736) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine
PubChem CID62771736
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1cnc(-c2ccncc2)nc1C
InChIInChI=1S/C15H20N4/c1-4-7-17-11(2)14-10-18-15(19-12(14)3)13-5-8-16-9-6-13/h5-6,8-11,17H,4,7H2,1-3H3
InChIKeyDYZQJNKRLHNLNH-UHFFFAOYSA-N
XLogP2.91
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)-N-[(2,4,5-trimethylphenyl)methyl]ethanamine
CID 29153348
4-methyl-5-propan-2-yl-2-pyridin-4-ylpyrimidine
CID 130210346
1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)-N-[(1-pyridin-3-ylpyrrol-2-yl)methyl]ethanamine
CID 45187858
N-[(1S)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-3-methylsulfanylpropanamide
CID 26398298
N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-1-phenylmethanesulfonamide
CID 72863472
2-N,2-N,6-trimethyl-4-N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidine-2,4-diamine
CID 70783075
methyl 5-[[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]amino]-5-oxopentanoate
CID 42195430
N,N,4-trimethyl-5-[1-(propylamino)ethyl]pyrimidin-2-amine
CID 62770147
1-ethyl-3,5-dimethyl-N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrazole-4-carboxamide
CID 72933838
6-cyclopropyl-N-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]pyrimidin-4-amine
CID 97156382
1-[2-(4-ethylphenyl)-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 62770310
N-ethyl-1-[4-methyl-2-(4-nitrophenyl)pyrimidin-5-yl]ethanamine
CID 62771904

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine (CID 62771736) is N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine is CCCNC(C)c1cnc(-c2ccncc2)nc1C.
What is the InChIKey of N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine?
The InChIKey is DYZQJNKRLHNLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-7-17-11(2)14-10-18-15(19-12(14)3)13-5-8-16-9-6-13/h5-6,8-11,17H,4,7H2,1-3H3.
What are the key properties of N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine?
N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine has a molecular weight of 256.35 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]propan-1-amine is sourced from PubChem (CID 62771736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).