5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine

C7H6ClN5 — CID 131203690

IUPAC5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine
SMILESClc1cnc(Nc2cnc[nH]2)nc1
InChIInChI=1S/C7H6ClN5/c8-5-1-10-7(11-2-5)13-6-3-9-4-12-6/h1-4H,(H,9,12)(H,10,11,13)
InChIKeyWEAYNSAYADLBMK-UHFFFAOYSA-N
MW195.61 g/mol
LogP1.60
Rot. Bonds2

About 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine

5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine (PubChem CID 131203690) has the molecular formula C7H6ClN5 and a molecular weight of 195.61 g/mol. Its IUPAC name is 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine
PubChem CID131203690
Molecular FormulaC7H6ClN5
Molecular Weight195.61 g/mol
Exact Mass195.03
IUPAC Name5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine
SMILESClc1cnc(Nc2cnc[nH]2)nc1
InChIInChI=1S/C7H6ClN5/c8-5-1-10-7(11-2-5)13-6-3-9-4-12-6/h1-4H,(H,9,12)(H,10,11,13)
InChIKeyWEAYNSAYADLBMK-UHFFFAOYSA-N
XLogP1.60
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.61
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-5-methylphenyl)-1H-imidazol-5-amine
CID 56975716
N-propan-2-yl-1H-imidazol-5-amine
CID 57320471
5-chloro-N-methylpyrimidin-2-amine;dihydrochloride
CID 175309566
N-[4-chloro-2-(methoxymethyl)phenyl]-1H-imidazol-5-amine
CID 118213355
N-(1H-imidazol-5-yl)formamide;hydrochloride
CID 174934160
N-(2,2-dimethylpropyl)-1H-imidazol-5-amine
CID 130635294
5-[(1H-imidazol-5-ylamino)methyl]pyrimidin-2-amine
CID 130693052
(5-chloropyrimidin-2-yl)urea
CID 144536009
2-(1H-imidazol-5-ylamino)propanenitrile
CID 141386432
5-chloro-N-prop-2-enylpyrimidin-2-amine
CID 79555505
N-(cyclopentylmethyl)-1H-imidazol-5-amine
CID 131176370
N-[(1-methylcyclopropyl)methyl]-1H-imidazol-5-amine
CID 130621456

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine?
The IUPAC name of 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine (CID 131203690) is 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine?
The canonical SMILES for 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine is Clc1cnc(Nc2cnc[nH]2)nc1.
What is the InChIKey of 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine?
The InChIKey is WEAYNSAYADLBMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5/c8-5-1-10-7(11-2-5)13-6-3-9-4-12-6/h1-4H,(H,9,12)(H,10,11,13).
What are the key properties of 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine?
5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine has a molecular weight of 195.61 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1H-imidazol-5-yl)pyrimidin-2-amine is sourced from PubChem (CID 131203690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).