N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine

C14H21N3O — CID 103987970

IUPACN-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)nc(CC2CCOC2)n1
InChIInChI=1S/C14H21N3O/c1-10-6-13(8-15-12-2-3-12)17-14(16-10)7-11-4-5-18-9-11/h6,11-12,15H,2-5,7-9H2,1H3
InChIKeySYNQTYXZLSIKFJ-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.62
Rot. Bonds5

About N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine

N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine (PubChem CID 103987970) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine
PubChem CID103987970
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)nc(CC2CCOC2)n1
InChIInChI=1S/C14H21N3O/c1-10-6-13(8-15-12-2-3-12)17-14(16-10)7-11-4-5-18-9-11/h6,11-12,15H,2-5,7-9H2,1H3
InChIKeySYNQTYXZLSIKFJ-UHFFFAOYSA-N
XLogP1.62
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine 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

[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]hydrazine
CID 103987906
N-[[6-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine
CID 55114430
N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]cyclopropanamine
CID 62746577
N-[(2-cycloheptyl-6-methylpyrimidin-4-yl)methyl]cyclopropanamine
CID 65399678
N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]oxetan-3-amine
CID 82893078
2-[4,6-dimethyl-2-(oxolan-3-ylmethyl)pyrimidin-5-yl]-N-methylethanamine
CID 103988011
N-[[2-(4-methoxyphenyl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
CID 62746575
N-[[6-methyl-2-(2-methylbutan-2-yloxy)pyrimidin-4-yl]methyl]cyclopropanamine
CID 114221207
N-[[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
CID 55114380
4-[3-(oxolan-3-ylmethyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclohexan-1-amine
CID 103988179
6-tert-butyl-N-ethyl-2-(oxolan-3-ylmethyl)pyrimidin-4-amine
CID 103987795
N-[[6-methyl-2-(3-methylbutan-2-yloxy)pyrimidin-4-yl]methyl]cyclopropanamine
CID 114221355

Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine (CID 103987970) is N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine is Cc1cc(CNC2CC2)nc(CC2CCOC2)n1.
What is the InChIKey of N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine?
The InChIKey is SYNQTYXZLSIKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10-6-13(8-15-12-2-3-12)17-14(16-10)7-11-4-5-18-9-11/h6,11-12,15H,2-5,7-9H2,1H3.
What are the key properties of N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine?
N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine has a molecular weight of 247.34 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 103987970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).