N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine

C15H25N3O — CID 66325561

IUPACN-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1ncnc(OCC)c1C)C1CC1
InChIInChI=1S/C15H25N3O/c1-4-8-16-14(12-6-7-12)9-13-11(3)15(19-5-2)18-10-17-13/h10,12,14,16H,4-9H2,1-3H3
InChIKeyFJZRUXYDVGMRLX-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.50
Rot. Bonds8

About N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine

N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine (PubChem CID 66325561) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine
PubChem CID66325561
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1ncnc(OCC)c1C)C1CC1
InChIInChI=1S/C15H25N3O/c1-4-8-16-14(12-6-7-12)9-13-11(3)15(19-5-2)18-10-17-13/h10,12,14,16H,4-9H2,1-3H3
InChIKeyFJZRUXYDVGMRLX-UHFFFAOYSA-N
XLogP2.50
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-cyclopropyl-2-(6-propoxypyrimidin-4-yl)ethyl]propan-1-amine
CID 66333010
N-[1-cyclopentyl-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 79825132
3-(6-ethoxy-5-methylpyrimidin-4-yl)-N-propylpentan-2-amine
CID 66325560
N-[1-(4-ethylcyclohexyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 64774218
N-[1-cyclopropyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 62600030
N-[1-cyclopropyl-2-(2,5-dimethylphenyl)ethyl]propan-1-amine
CID 61482130
N-[1-cyclopropyl-2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
CID 63912853
N-[1-cyclopropyl-2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)ethyl]propan-1-amine
CID 55202827
N-[1-cyclopropyl-2-(4-methylpyrazol-1-yl)ethyl]propan-1-amine
CID 63911994
N-[1-(3,4-dimethylcyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 64739453
N-[1-(4,4-difluorocyclohexyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105159068
N-[1-(4-propan-2-ylcyclohexyl)-2-thiophen-2-ylethyl]propan-1-amine
CID 65424402

Frequently Asked Questions

What is the IUPAC name of N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine (CID 66325561) is N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine is CCCNC(Cc1ncnc(OCC)c1C)C1CC1.
What is the InChIKey of N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine?
The InChIKey is FJZRUXYDVGMRLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-8-16-14(12-6-7-12)9-13-11(3)15(19-5-2)18-10-17-13/h10,12,14,16H,4-9H2,1-3H3.
What are the key properties of N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine?
N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclopropyl-2-(6-ethoxy-5-methylpyrimidin-4-yl)ethyl]propan-1-amine is sourced from PubChem (CID 66325561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).