2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine

C11H19N3 — CID 62785872

IUPAC2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine
SMILESCc1nccc(NC(C)CC(C)C)n1
InChIInChI=1S/C11H19N3/c1-8(2)7-9(3)13-11-5-6-12-10(4)14-11/h5-6,8-9H,7H2,1-4H3,(H,12,13,14)
InChIKeyPJEHIYHZIJGDSE-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.63
Rot. Bonds4

About 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine

2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine (PubChem CID 62785872) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine
PubChem CID62785872
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine
SMILESCc1nccc(NC(C)CC(C)C)n1
InChIInChI=1S/C11H19N3/c1-8(2)7-9(3)13-11-5-6-12-10(4)14-11/h5-6,8-9H,7H2,1-4H3,(H,12,13,14)
InChIKeyPJEHIYHZIJGDSE-UHFFFAOYSA-N
XLogP2.63
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-N-(2-methylpyrimidin-4-yl)pentane-1,2-diamine
CID 63759606
2-methyl-N-(4,4,4-trifluorobutan-2-yl)pyrimidin-4-amine
CID 104854561
2-N,4-N-di(butan-2-yl)pyrimidine-2,4-diamine
CID 112883470
(2S)-2-[(2-methylpyrimidin-4-yl)amino]butan-1-ol
CID 94586923
6-N-(4-methylpentan-2-yl)pyridine-2,3,6-triamine
CID 79826217
N-[1-(4-bromophenyl)ethyl]-2-methylpyrimidin-4-amine
CID 55112715
2-methyl-N-(7-methyloctyl)pyrimidin-4-amine
CID 107816212
4-N-(4-methylhexan-2-yl)pyrimidine-2,4-diamine
CID 80846918
2-methyl-N-(2,3,3-trimethylbutyl)pyrimidin-4-amine
CID 79033671
2-methyl-N-(2-methylbutyl)pyrimidin-4-amine
CID 62769511
2-methyl-N-phosphanylpyrimidin-4-amine
CID 59105384
3-bromo-4-methyl-N-(4-methylpentan-2-yl)pyridin-2-amine
CID 106875484

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine?
The IUPAC name of 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine (CID 62785872) is 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine is Cc1nccc(NC(C)CC(C)C)n1.
What is the InChIKey of 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine?
The InChIKey is PJEHIYHZIJGDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8(2)7-9(3)13-11-5-6-12-10(4)14-11/h5-6,8-9H,7H2,1-4H3,(H,12,13,14).
What are the key properties of 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine?
2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine has a molecular weight of 193.29 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methylpentan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 62785872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).