2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine

C16H23N5 — CID 80974848

IUPAC2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine
SMILESCCCn1ccnc1-c1nc(C2CC2)nc(NCC)c1C
InChIInChI=1S/C16H23N5/c1-4-9-21-10-8-18-16(21)13-11(3)14(17-5-2)20-15(19-13)12-6-7-12/h8,10,12H,4-7,9H2,1-3H3,(H,17,19,20)
InChIKeyZDAPMSYRHLBOER-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.37
Rot. Bonds6

About 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine

2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine (PubChem CID 80974848) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine
PubChem CID80974848
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine
SMILESCCCn1ccnc1-c1nc(C2CC2)nc(NCC)c1C
InChIInChI=1S/C16H23N5/c1-4-9-21-10-8-18-16(21)13-11(3)14(17-5-2)20-15(19-13)12-6-7-12/h8,10,12H,4-7,9H2,1-3H3,(H,17,19,20)
InChIKeyZDAPMSYRHLBOER-UHFFFAOYSA-N
XLogP3.37
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylpyrazol-3-yl)pyrimidin-4-amine
CID 80976475
N-ethyl-6-(1-ethylimidazol-2-yl)-5-methyl-2-propylpyrimidin-4-amine
CID 80976649
2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine
CID 80975895
2-cyclopropyl-N-ethyl-5-methyl-6-(3-methyl-4-pyridinyl)pyrimidin-4-amine
CID 80976322
6-(4-bromothiophen-3-yl)-2-cyclopropyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80976410
4-N-butyl-2-cyclopropyl-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80981195
2-cyclopropyl-N-ethyl-5-methyl-6-propoxypyrimidin-4-amine
CID 80988977
2-cyclopropyl-5-methyl-6-(2-methylimidazol-1-yl)-N-propylpyrimidin-4-amine
CID 80992611
2-cyclopropyl-6-[(1-ethylimidazol-2-yl)methyl]-N,5-dimethylpyrimidin-4-amine
CID 80976414
2-cyclopropyl-6-N-ethyl-4-N-hexyl-5-methylpyrimidine-4,6-diamine
CID 80985625
2-cyclopropyl-5-methyl-6-(1-methylimidazol-2-yl)sulfanyl-N-propylpyrimidin-4-amine
CID 80990773
6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80974842

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine (CID 80974848) is 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine is CCCn1ccnc1-c1nc(C2CC2)nc(NCC)c1C.
What is the InChIKey of 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine?
The InChIKey is ZDAPMSYRHLBOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-4-9-21-10-8-18-16(21)13-11(3)14(17-5-2)20-15(19-13)12-6-7-12/h8,10,12H,4-7,9H2,1-3H3,(H,17,19,20).
What are the key properties of 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine?
2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 80974848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).