1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine

C12H14N4 — CID 115530469

IUPAC1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine
SMILESCc1nccc(C(N)Cc2ccncc2)n1
InChIInChI=1S/C12H14N4/c1-9-15-7-4-12(16-9)11(13)8-10-2-5-14-6-3-10/h2-7,11H,8,13H2,1H3
InChIKeyRXMFSSLHJGDWRQ-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.42
Rot. Bonds3

About 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine

1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine (PubChem CID 115530469) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine
PubChem CID115530469
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine
SMILESCc1nccc(C(N)Cc2ccncc2)n1
InChIInChI=1S/C12H14N4/c1-9-15-7-4-12(16-9)11(13)8-10-2-5-14-6-3-10/h2-7,11H,8,13H2,1H3
InChIKeyRXMFSSLHJGDWRQ-UHFFFAOYSA-N
XLogP1.42
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-iodophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530048
2-(3-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530243
1-(2-methylpyrimidin-4-yl)-2-naphthalen-1-ylethanamine
CID 115530277
(1S)-3,3,3-trifluoro-1-(2-methylpyrimidin-4-yl)propan-1-amine
CID 104941101
(1R)-3,3,3-trifluoro-1-(2-methylpyrimidin-4-yl)propan-1-amine
CID 104941079
2-(5-bromothiophen-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530366
3-amino-3-(2-methylpyrimidin-4-yl)propanamide
CID 115527138
2-(2,3-difluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 113329452
2-(2,5-dimethylpyrazol-3-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 113329517
1-(1,3-oxazol-2-yl)-2-pyridin-4-ylethanamine
CID 82404673
1-(4-methylphenyl)-2-pyridin-4-ylethanamine
CID 62550879
2-(2-chloro-5-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 102619243

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine?
The IUPAC name of 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine (CID 115530469) is 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine.
What is the SMILES notation for 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine?
The canonical SMILES for 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine is Cc1nccc(C(N)Cc2ccncc2)n1.
What is the InChIKey of 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine?
The InChIKey is RXMFSSLHJGDWRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-9-15-7-4-12(16-9)11(13)8-10-2-5-14-6-3-10/h2-7,11H,8,13H2,1H3.
What are the key properties of 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine?
1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine has a molecular weight of 214.27 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrimidin-4-yl)-2-pyridin-4-ylethanamine is sourced from PubChem (CID 115530469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).