N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine

C15H23NO — CID 43489767

IUPACN-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine
SMILESCCNC(c1ccc(CCOC)cc1)C1CC1
InChIInChI=1S/C15H23NO/c1-3-16-15(14-8-9-14)13-6-4-12(5-7-13)10-11-17-2/h4-7,14-16H,3,8-11H2,1-2H3
InChIKeyKUNIVGPQHAWNRS-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.94
Rot. Bonds7

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

N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine (PubChem CID 43489767) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine
PubChem CID43489767
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine
SMILESCCNC(c1ccc(CCOC)cc1)C1CC1
InChIInChI=1S/C15H23NO/c1-3-16-15(14-8-9-14)13-6-4-12(5-7-13)10-11-17-2/h4-7,14-16H,3,8-11H2,1-2H3
InChIKeyKUNIVGPQHAWNRS-UHFFFAOYSA-N
XLogP2.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclopropyl-(4-propylphenyl)methyl]ethanamine
CID 43491617
1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine
CID 43482389
N-[cyclopentyl-[4-(2-methoxyethyl)phenyl]methyl]propan-1-amine
CID 43495393
N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine
CID 43489770
N-[[4-(2-methoxyethyl)phenyl]-(5-methyloxolan-2-yl)methyl]ethanamine
CID 81330130
N-[(S)-cyclopropyl-(4-methoxyphenyl)methyl]ethanamine
CID 93040874
N-[(4,4-dimethylcyclohexyl)-(4-propylphenyl)methyl]ethanamine
CID 65390054
1-[chloro(cyclopropyl)methyl]-4-(2-methoxyethyl)benzene
CID 61084514
N-[(4-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]ethanamine
CID 65423233
N-[(4-bromophenyl)-cyclopropylmethyl]ethanamine
CID 43488686
N-[[4-(2-methoxyethyl)phenyl]-(oxan-3-yl)methyl]propan-1-amine
CID 63012897
N-[cyclopropyl-(4-cyclopropyloxyphenyl)methyl]ethanamine
CID 114519282

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine?
The IUPAC name of N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine (CID 43489767) is N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine?
The canonical SMILES for N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine is CCNC(c1ccc(CCOC)cc1)C1CC1.
What is the InChIKey of N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine?
The InChIKey is KUNIVGPQHAWNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-16-15(14-8-9-14)13-6-4-12(5-7-13)10-11-17-2/h4-7,14-16H,3,8-11H2,1-2H3.
What are the key properties of N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine?
N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine has a molecular weight of 233.35 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine is sourced from PubChem (CID 43489767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).