N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine

C15H24N4O — CID 115974493

IUPACN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine
SMILESCCOc1cc(C)nc(NCC2CCN(C3CC3)C2)n1
InChIInChI=1S/C15H24N4O/c1-3-20-14-8-11(2)17-15(18-14)16-9-12-6-7-19(10-12)13-4-5-13/h8,12-13H,3-7,9-10H2,1-2H3,(H,16,17,18)
InChIKeyKHTGOVGWDGTKMS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.08
Rot. Bonds6

About N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine (PubChem CID 115974493) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine
PubChem CID115974493
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine
SMILESCCOc1cc(C)nc(NCC2CCN(C3CC3)C2)n1
InChIInChI=1S/C15H24N4O/c1-3-20-14-8-11(2)17-15(18-14)16-9-12-6-7-19(10-12)13-4-5-13/h8,12-13H,3-7,9-10H2,1-2H3,(H,16,17,18)
InChIKeyKHTGOVGWDGTKMS-UHFFFAOYSA-N
XLogP2.08
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112691744
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-methylpyrimidin-2-amine
CID 62959994
4-ethoxy-6-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 112638139
N-[(3-chlorocyclohexyl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine
CID 114146703
4-ethoxy-6-methyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine
CID 112634792
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66324847
N-(4-ethoxy-6-methylpyrimidin-2-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 112637279
N-cyclopropyl-4-ethoxy-6-methylpyrimidin-2-amine
CID 94830490
4-methyl-N-[(3-methylcyclopentyl)methyl]-6-propoxypyrimidin-2-amine
CID 107414062
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-methylquinolin-4-amine
CID 60858147
4,6-dimethyl-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrimidin-2-amine
CID 60856650
1-[1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-yl]-N-methylmethanamine
CID 112634859

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine?
The IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine (CID 115974493) is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine.
What is the SMILES notation for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine?
The canonical SMILES for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine is CCOc1cc(C)nc(NCC2CCN(C3CC3)C2)n1.
What is the InChIKey of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine?
The InChIKey is KHTGOVGWDGTKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-20-14-8-11(2)17-15(18-14)16-9-12-6-7-19(10-12)13-4-5-13/h8,12-13H,3-7,9-10H2,1-2H3,(H,16,17,18).
What are the key properties of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine?
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine has a molecular weight of 276.38 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethoxy-6-methylpyrimidin-2-amine is sourced from PubChem (CID 115974493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).