(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine

C19H23NO — CID 105018334

IUPAC(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine
SMILESCC(C)Oc1ccccc1C(N)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-13(2)21-18-11-7-6-10-15(18)19(20)17-12-16(17)14-8-4-3-5-9-14/h3-11,13,16-17,19H,12,20H2,1-2H3
InChIKeyHVPSJOXBSNKQBN-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.28
Rot. Bonds5

About (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine

(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine (PubChem CID 105018334) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine.

Molecular Properties

Compound Name(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine
PubChem CID105018334
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine
SMILESCC(C)Oc1ccccc1C(N)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-13(2)21-18-11-7-6-10-15(18)19(20)17-12-16(17)14-8-4-3-5-9-14/h3-11,13,16-17,19H,12,20H2,1-2H3
InChIKeyHVPSJOXBSNKQBN-UHFFFAOYSA-N
XLogP4.28
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 ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-cyclopropyl-(2-propan-2-yloxyphenyl)methanamine;hydrochloride
CID 171211944
(2-bromophenyl)-[(1R,2S)-2-phenylcyclopropyl]methanamine
CID 138039926
(3-methoxy-4-pyridinyl)-(2-phenylcyclopropyl)methanamine
CID 105066143
(2-chlorophenyl)-(2-phenylcyclopropyl)methanamine;hydrochloride
CID 138040827
1-[(1R,2S)-2-phenylcyclopropyl]ethanamine
CID 57373127
7-bicyclo[4.1.0]heptanyl-(2-propan-2-yloxyphenyl)methanamine
CID 105018412
(2,4-dibromophenyl)-(2-phenylcyclopropyl)methanamine
CID 107946944
(3-bromo-2-fluorophenyl)-(2-phenylcyclopropyl)methanamine
CID 106648123
(2-bromo-4-fluorophenyl)-(2-phenylcyclopropyl)methanamine
CID 105052652
3-methyl-1-(2-phenylcyclopropyl)butan-1-amine
CID 116517331
1-(2-phenylcyclopropyl)propan-1-amine
CID 116517334
(2-propan-2-yloxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 105018368

Frequently Asked Questions

What is the IUPAC name of (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine?
The IUPAC name of (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine (CID 105018334) is (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine.
What is the SMILES notation for (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine?
The canonical SMILES for (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine is CC(C)Oc1ccccc1C(N)C1CC1c1ccccc1.
What is the InChIKey of (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine?
The InChIKey is HVPSJOXBSNKQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-13(2)21-18-11-7-6-10-15(18)19(20)17-12-16(17)14-8-4-3-5-9-14/h3-11,13,16-17,19H,12,20H2,1-2H3.
What are the key properties of (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine?
(2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine has a molecular weight of 281.40 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylcyclopropyl)-(2-propan-2-yloxyphenyl)methanamine is sourced from PubChem (CID 105018334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).