N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine

C19H23NO — CID 62703658

IUPACN-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1CC1c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-2-20-13-17-12-19(17)16-8-10-18(11-9-16)21-14-15-6-4-3-5-7-15/h3-11,17,19-20H,2,12-14H2,1H3
InChIKeyKXAKQGWOXZPUHQ-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.98
Rot. Bonds7

About N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine

N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine (PubChem CID 62703658) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine
PubChem CID62703658
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1CC1c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-2-20-13-17-12-19(17)16-8-10-18(11-9-16)21-14-15-6-4-3-5-7-15/h3-11,17,19-20H,2,12-14H2,1H3
InChIKeyKXAKQGWOXZPUHQ-UHFFFAOYSA-N
XLogP3.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine 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

cis-(1R,2R)-2-(4-phenylmethoxyphenyl)cyclopropan-1-amine
CID 51888240
1-[(2R)-2-methylcyclopropyl]-4-phenylmethoxybenzene
CID 121309338
4-[2-(ethylaminomethyl)cyclopropyl]phenol
CID 82228522
1-[(1S,2R)-2-bromocyclopropyl]-4-phenylmethoxybenzene
CID 130539986
N-[[2-(4-ethoxyphenyl)cyclopropyl]methyl]-2-methylpropan-1-amine
CID 62712637
1-[(1S)-2-nitrocyclopropyl]-4-phenylmethoxybenzene
CID 134350485
N-methyl-2-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 56787945
4-ethyl-N-[(1S,2R)-2-(4-phenylmethoxyphenyl)cyclopropyl]cyclohexan-1-amine
CID 158438247
trans-ethyl (1R,2R)-2-(4-phenylmethoxyphenyl)cyclopropane-1-carboxylate
CID 66714771
2-methyl-N-[[2-(4-propoxyphenyl)cyclopropyl]methyl]propan-1-amine
CID 55210303
[2-(4-phenylmethoxyphenyl)cyclopropyl] butanoate
CID 174231833
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-(4-phenylmethoxyphenoxy)ethanone;hydrochloride
CID 119644698

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine (CID 62703658) is N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine is CCNCC1CC1c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine?
The InChIKey is KXAKQGWOXZPUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-20-13-17-12-19(17)16-8-10-18(11-9-16)21-14-15-6-4-3-5-7-15/h3-11,17,19-20H,2,12-14H2,1H3.
What are the key properties of N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine?
N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine has a molecular weight of 281.40 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-phenylmethoxyphenyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 62703658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).