2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine

C10H12N4 — CID 82468666

IUPAC2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine
SMILESCc1nc(C)c(N)c(-c2cc[nH]c2)n1
InChIInChI=1S/C10H12N4/c1-6-9(11)10(14-7(2)13-6)8-3-4-12-5-8/h3-5,12H,11H2,1-2H3
InChIKeyMGYSMCCPNVBJTD-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.67
Rot. Bonds1

About 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine

2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine (PubChem CID 82468666) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine.

Molecular Properties

Compound Name2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine
PubChem CID82468666
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine
SMILESCc1nc(C)c(N)c(-c2cc[nH]c2)n1
InChIInChI=1S/C10H12N4/c1-6-9(11)10(14-7(2)13-6)8-3-4-12-5-8/h3-5,12H,11H2,1-2H3
InChIKeyMGYSMCCPNVBJTD-UHFFFAOYSA-N
XLogP1.67
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidine-5-carboxylic acid
CID 82285097
5-bromo-2-methyl-4-(1H-pyrrol-3-yl)pyrimidine
CID 96590663
2-methyl-4-(1H-pyrrol-3-yl)pyrimidine-5-carboxylic acid
CID 82282573
[4-methyl-6-(1H-pyrrol-3-yl)pyrimidin-5-yl]methanamine
CID 83530552
4-(1H-pyrrol-3-yl)-1,3-thiazole-2,5-diamine
CID 82468326
4-(2,3-dihydro-1H-inden-5-yl)-2,6-dimethylpyrimidin-5-amine
CID 82388247
5-propan-2-yl-4-(1H-pyrrol-3-yl)-1,3-oxazol-2-amine
CID 116832000
[5-methyl-4-(1H-pyrrol-3-yl)-1,3-oxazol-2-yl]methanamine
CID 82280585
5-phenyl-4-(1H-pyrrol-3-yl)pyrimidin-2-amine
CID 90945303
5-bromo-4-(1H-pyrrol-3-yl)-1,3-thiazol-2-amine
CID 83720866
N,5-dimethyl-3-(1H-pyrrol-3-yl)-1H-pyrazol-4-amine
CID 136995812
4,5-dimethyl-2-(1H-pyrrol-3-yl)-1,3-thiazole
CID 136988755

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine?
The IUPAC name of 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine (CID 82468666) is 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine.
What is the SMILES notation for 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine?
The canonical SMILES for 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine is Cc1nc(C)c(N)c(-c2cc[nH]c2)n1.
What is the InChIKey of 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine?
The InChIKey is MGYSMCCPNVBJTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-6-9(11)10(14-7(2)13-6)8-3-4-12-5-8/h3-5,12H,11H2,1-2H3.
What are the key properties of 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine?
2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine has a molecular weight of 188.23 g/mol, XLogP of 1.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(1H-pyrrol-3-yl)pyrimidin-5-amine is sourced from PubChem (CID 82468666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).