5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine

C10H10ClN5 — CID 105369387

IUPAC5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(CNc2ncncc2Cl)cn1
InChIInChI=1S/C10H10ClN5/c1-7-2-14-8(3-13-7)4-15-10-9(11)5-12-6-16-10/h2-3,5-6H,4H2,1H3,(H,12,15,16)
InChIKeyHPUJHIDRALHALZ-UHFFFAOYSA-N
MW235.68 g/mol
LogP1.84
Rot. Bonds3

About 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine

5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine (PubChem CID 105369387) has the molecular formula C10H10ClN5 and a molecular weight of 235.68 g/mol. Its IUPAC name is 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
PubChem CID105369387
Molecular FormulaC10H10ClN5
Molecular Weight235.68 g/mol
Exact Mass235.06
IUPAC Name5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(CNc2ncncc2Cl)cn1
InChIInChI=1S/C10H10ClN5/c1-7-2-14-8(3-13-7)4-15-10-9(11)5-12-6-16-10/h2-3,5-6H,4H2,1H3,(H,12,15,16)
InChIKeyHPUJHIDRALHALZ-UHFFFAOYSA-N
XLogP1.84
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.68
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-((6-((3-Aminopropyl)amino)pyrimidin-4-yl)amino)pyrazine-2-carbonitrile
CID 42610564
5-chloro-2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(1-methylimidazol-4-yl)pyrimidine-2,4-diamine
CID 46176417
5-((6-((2-Aminoethyl)amino)pyrimidin-4-yl)amino)pyrazine-2-carbonitrile
CID 42610563
6-(6-chloropyrazin-2-yl)-2-N,4-N-bis(1,1,1-trifluoropropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 117817111
5-fluoro-N~4~,N~4~-dimethyl-N~2~-(2-pyrazin-2-ylethyl)pyrimidine-2,4-diamine
CID 72867800
6-Chloropteridine
CID 23424051
7-Chloropteridine
CID 23424052
2-Chloro-6-(pyrimidin-2-yl)pyrazine
CID 138987910
Pteridine, 4-amino-7-chloro-
CID 119097475
Pteridine, 2,4-bismethylamino-
CID 129928620
Pteridine, 2-propylamino-
CID 129929523
(6-(Methylamino)methyl)pteridine-2,4-diamine
CID 17889689

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine (CID 105369387) is 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine is Cc1cnc(CNc2ncncc2Cl)cn1.
What is the InChIKey of 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is HPUJHIDRALHALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5/c1-7-2-14-8(3-13-7)4-15-10-9(11)5-12-6-16-10/h2-3,5-6H,4H2,1H3,(H,12,15,16).
What are the key properties of 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 235.68 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 105369387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).