6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine

C14H25N5 — CID 46225991

IUPAC6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)C)nc(NCCN2CCCC2)n1
InChIInChI=1S/C14H25N5/c1-11(2)16-13-10-12(3)17-14(18-13)15-6-9-19-7-4-5-8-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyOXPKURVUSINFOP-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.11
Rot. Bonds6

About 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine

6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine (PubChem CID 46225991) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine
PubChem CID46225991
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)C)nc(NCCN2CCCC2)n1
InChIInChI=1S/C14H25N5/c1-11(2)16-13-10-12(3)17-14(18-13)15-6-9-19-7-4-5-8-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyOXPKURVUSINFOP-UHFFFAOYSA-N
XLogP2.11
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-(2-piperidin-1-ylethyl)-6-propan-2-yloxypyrimidin-2-amine
CID 115974823
6-methyl-2-(2-piperidin-1-ylethylamino)pyrimidine-4-carbothioamide
CID 107546988
6-methyl-2-N-(2-morpholin-4-ylethyl)-4-N-(2,4,6-trimethylphenyl)pyrimidine-2,4-diamine
CID 112913352
4-methyl-N-(2-morpholin-4-ylethyl)-6-piperidin-1-ylpyrimidin-2-amine
CID 112909978
2-N-[3-(dimethylamino)propyl]-6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112913122
6-methyl-4-N-piperidin-1-yl-2-N-propylpyrimidine-2,4-diamine
CID 83027527
4-N-(4-tert-butylphenyl)-6-methyl-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112913356
6-methyl-2-N-(2-morpholin-4-ylethyl)-4-N-(2-phenylethyl)pyrimidine-2,4-diamine
CID 112913296
6-methyl-2-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyrimidine-4-carboxamide
CID 109319463
methyl 4-[2-(azepan-1-yl)ethylamino]-6-methylpyrimidine-2-carboxylate
CID 66285238
2-N-tert-butyl-6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112913170
6-methyl-4-N-(2-morpholin-4-ylethyl)-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112913144

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine?
The IUPAC name of 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine (CID 46225991) is 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine is Cc1cc(NC(C)C)nc(NCCN2CCCC2)n1.
What is the InChIKey of 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine?
The InChIKey is OXPKURVUSINFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-11(2)16-13-10-12(3)17-14(18-13)15-6-9-19-7-4-5-8-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine?
6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine has a molecular weight of 263.39 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-N-propan-2-yl-2-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 46225991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).