1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine

C11H17N3O — CID 116731055

IUPAC1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine
SMILESCNCc1ccnc(C(OC)C2CC2)n1
InChIInChI=1S/C11H17N3O/c1-12-7-9-5-6-13-11(14-9)10(15-2)8-3-4-8/h5-6,8,10,12H,3-4,7H2,1-2H3
InChIKeyIBCVURNGHTXAJT-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.29
Rot. Bonds5

About 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine

1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine (PubChem CID 116731055) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine
PubChem CID116731055
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine
SMILESCNCc1ccnc(C(OC)C2CC2)n1
InChIInChI=1S/C11H17N3O/c1-12-7-9-5-6-13-11(14-9)10(15-2)8-3-4-8/h5-6,8,10,12H,3-4,7H2,1-2H3
InChIKeyIBCVURNGHTXAJT-UHFFFAOYSA-N
XLogP1.29
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(1-methoxypropyl)pyrimidin-4-yl]-N-methylmethanamine
CID 116731053
[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]hydrazine
CID 116730368
1-[2-[cyclohexyl(methoxy)methyl]pyrimidin-4-yl]propan-2-amine
CID 116779150
N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine
CID 65402198
N-[[2-[cyclohexyl(ethoxy)methyl]pyrimidin-4-yl]methyl]propan-2-amine
CID 116778533
N-methyl-1-[2-(1-methylsulfonylethyl)pyrimidin-4-yl]methanamine
CID 116633380
1-(2-cyclobutylpyrimidin-4-yl)-N-methylmethanamine
CID 64985841
1-(2-cyclohexylpyrimidin-4-yl)-N-methylmethanamine
CID 62747376
N-methyl-1-[2-(2-methylcyclopropyl)pyrimidin-4-yl]methanamine
CID 65421316
N-[[2-[cyclopropyl(methoxy)methyl]-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
CID 116731176
1-[2-[cyclopropyl(methoxy)methyl]-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 116731318
2-[cyclopropyl(methoxy)methyl]-N,7,7-trimethyl-6,8-dihydro-5H-quinazolin-5-amine
CID 116728350

Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine (CID 116731055) is 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine is CNCc1ccnc(C(OC)C2CC2)n1.
What is the InChIKey of 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine?
The InChIKey is IBCVURNGHTXAJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-12-7-9-5-6-13-11(14-9)10(15-2)8-3-4-8/h5-6,8,10,12H,3-4,7H2,1-2H3.
What are the key properties of 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine?
1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine has a molecular weight of 207.28 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 116731055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).