(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine

C19H23NO — CID 63079875

IUPAC(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine
SMILESCCOc1ccccc1C(N)C1(c2ccccc2)CCC1
InChIInChI=1S/C19H23NO/c1-2-21-17-12-7-6-11-16(17)18(20)19(13-8-14-19)15-9-4-3-5-10-15/h3-7,9-12,18H,2,8,13-14,20H2,1H3
InChIKeyWLVLNFBXHDZTRU-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.21
Rot. Bonds5

About (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine

(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine (PubChem CID 63079875) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine.

Molecular Properties

Compound Name(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine
PubChem CID63079875
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine
SMILESCCOc1ccccc1C(N)C1(c2ccccc2)CCC1
InChIInChI=1S/C19H23NO/c1-2-21-17-12-7-6-11-16(17)18(20)19(13-8-14-19)15-9-4-3-5-10-15/h3-7,9-12,18H,2,8,13-14,20H2,1H3
InChIKeyWLVLNFBXHDZTRU-UHFFFAOYSA-N
XLogP4.21
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methoxyphenyl)-(1-phenylcyclopentyl)methanamine
CID 63080445
(2-ethoxyphenyl)-(1-phenylcyclopropyl)methanol
CID 63079301
1-[amino-(2-ethoxyphenyl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79059165
1-[amino-(2-ethoxyphenyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79061084
(1S)-1-(2-ethoxyphenyl)propan-1-amine;hydrochloride
CID 171221746
1-[bis(2-ethoxyphenyl)methyl]-2-ethoxybenzene
CID 173071394
(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine
CID 124705479
2-[chloro-(1-phenylcyclopropyl)methyl]-1-ethoxy-4-methylbenzene
CID 63447962
(2,3-difluorophenyl)-(1-phenylcyclopentyl)methanamine
CID 63988826
(1-phenylcyclobutyl)-(2,3,4-trifluorophenyl)methanamine
CID 63080571
(2,4-dimethylphenyl)-(1-phenylcyclopentyl)methanamine
CID 63418067
1-benzothiophen-7-yl-(1-phenylcyclobutyl)methanamine
CID 81128732

Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine?
The IUPAC name of (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine (CID 63079875) is (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine.
What is the SMILES notation for (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine?
The canonical SMILES for (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine is CCOc1ccccc1C(N)C1(c2ccccc2)CCC1.
What is the InChIKey of (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine?
The InChIKey is WLVLNFBXHDZTRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-21-17-12-7-6-11-16(17)18(20)19(13-8-14-19)15-9-4-3-5-10-15/h3-7,9-12,18H,2,8,13-14,20H2,1H3.
What are the key properties of (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine?
(2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine has a molecular weight of 281.40 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-(1-phenylcyclobutyl)methanamine is sourced from PubChem (CID 63079875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).