6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine

C10H10ClN5 — CID 58973138

IUPAC6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine
SMILESClc1nccn1-c1cc(NC2CC2)ncn1
InChIInChI=1S/C10H10ClN5/c11-10-12-3-4-16(10)9-5-8(13-6-14-9)15-7-1-2-7/h3-7H,1-2H2,(H,13,14,15)
InChIKeyJTBUUVKWMWALQC-UHFFFAOYSA-N
MW235.68 g/mol
LogP1.89
Rot. Bonds3

About 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine

6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine (PubChem CID 58973138) has the molecular formula C10H10ClN5 and a molecular weight of 235.68 g/mol. Its IUPAC name is 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine
PubChem CID58973138
Molecular FormulaC10H10ClN5
Molecular Weight235.68 g/mol
Exact Mass235.06
IUPAC Name6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine
SMILESClc1nccn1-c1cc(NC2CC2)ncn1
InChIInChI=1S/C10H10ClN5/c11-10-12-3-4-16(10)9-5-8(13-6-14-9)15-7-1-2-7/h3-7H,1-2H2,(H,13,14,15)
InChIKeyJTBUUVKWMWALQC-UHFFFAOYSA-N
XLogP1.89
TPSA55.63 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 ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
CID 155941701
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
1-[6-(cyclobutylamino)pyrimidin-4-yl]piperidin-4-ol
CID 115265259
1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-ol
CID 66569760
N-cycloheptyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112863363
N-[3-[[1-[6-(cyclopropylamino)pyrimidin-4-yl]imidazol-2-yl]amino]-4-fluorophenyl]benzamide
CID 58973162
N-cyclopropyl-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 112854724
N-cyclopentyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112855879
N-cyclohexyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
CID 155941768
4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 115265146
N-[4-chloro-3-[[1-[6-(cyclopropylamino)pyrimidin-4-yl]imidazol-2-yl]amino]phenyl]-3-(dimethylamino)-5-(trifluoromethyl)benzamide
CID 58973092
N-cyclopropyl-6-pyrimidin-5-ylpyrimidin-4-amine
CID 141185839

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine?
The IUPAC name of 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine (CID 58973138) is 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine?
The canonical SMILES for 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine is Clc1nccn1-c1cc(NC2CC2)ncn1.
What is the InChIKey of 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine?
The InChIKey is JTBUUVKWMWALQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5/c11-10-12-3-4-16(10)9-5-8(13-6-14-9)15-7-1-2-7/h3-7H,1-2H2,(H,13,14,15).
What are the key properties of 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine?
6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine has a molecular weight of 235.68 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine is sourced from PubChem (CID 58973138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).