4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine

C14H24N4 — CID 80821555

IUPAC4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(N(CC2CC2)C(C)C)n1
InChIInChI=1S/C14H24N4/c1-5-15-14-16-11(4)8-13(17-14)18(10(2)3)9-12-6-7-12/h8,10,12H,5-7,9H2,1-4H3,(H,15,16,17)
InChIKeyFBNPYHFIRIYUSE-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.84
Rot. Bonds6

About 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine

4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine (PubChem CID 80821555) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine
PubChem CID80821555
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(N(CC2CC2)C(C)C)n1
InChIInChI=1S/C14H24N4/c1-5-15-14-16-11(4)8-13(17-14)18(10(2)3)9-12-6-7-12/h8,10,12H,5-7,9H2,1-4H3,(H,15,16,17)
InChIKeyFBNPYHFIRIYUSE-UHFFFAOYSA-N
XLogP2.84
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-ethyl-6-methyl-4-N-propan-2-yl-4-N-propylpyrimidine-2,4-diamine
CID 80775316
4-N-(cyclobutylmethyl)-2-N,4-N-diethyl-6-methylpyrimidine-2,4-diamine
CID 107403115
3-[[2-(ethylamino)-6-methylpyrimidin-4-yl]-propan-2-ylamino]propanenitrile
CID 80811463
4-N-(cyclopropylmethyl)-6-N-ethyl-4-N-propan-2-ylpyrimidine-2,4,6-triamine
CID 80820583
2-tert-butyl-4-N-(cyclopropylmethyl)-6-N-ethyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80961049
2-N-ethyl-6-methyl-4-N-propan-2-yl-4-N-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine
CID 80808333
4-N-(cyclopropylmethyl)-6-N,2-dimethyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80821545
2-N-(cyclopropylmethyl)-6-ethoxy-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 80820904
4-N-(cyclopropylmethyl)-2-N-ethyl-4-N-propan-2-ylquinazoline-2,4-diamine
CID 80786859
N-(cyclopropylmethyl)-6-hydrazinyl-2-methyl-N-propan-2-ylpyrimidin-4-amine
CID 80905091
N-(cyclopropylmethyl)-N-ethyl-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80912871
2-hydrazinyl-6-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
CID 80904244

Frequently Asked Questions

What is the IUPAC name of 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine (CID 80821555) is 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine is CCNc1nc(C)cc(N(CC2CC2)C(C)C)n1.
What is the InChIKey of 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine?
The InChIKey is FBNPYHFIRIYUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-5-15-14-16-11(4)8-13(17-14)18(10(2)3)9-12-6-7-12/h8,10,12H,5-7,9H2,1-4H3,(H,15,16,17).
What are the key properties of 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine?
4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine has a molecular weight of 248.37 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(cyclopropylmethyl)-2-N-ethyl-6-methyl-4-N-propan-2-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 80821555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).