(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol

C15H23NO — CID 2416449

IUPAC(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol
SMILESCCCN(CC1CC1)C[C@H](O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-10-16(11-13-8-9-13)12-15(17)14-6-4-3-5-7-14/h3-7,13,15,17H,2,8-12H2,1H3/t15-/m0/s1
InChIKeyPFZDNVITBTUXLN-HNNXBMFYSA-N
MW233.36 g/mol
LogP2.84
Rot. Bonds7

About (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol

(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol (PubChem CID 2416449) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol.

Molecular Properties

Compound Name(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol
PubChem CID2416449
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol
SMILESCCCN(CC1CC1)C[C@H](O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-10-16(11-13-8-9-13)12-15(17)14-6-4-3-5-7-14/h3-7,13,15,17H,2,8-12H2,1H3/t15-/m0/s1
InChIKeyPFZDNVITBTUXLN-HNNXBMFYSA-N
XLogP2.84
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol 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

1-(4-aminophenyl)-2-[cyclopropylmethyl(propyl)amino]ethanol
CID 55055537
2-[cyclopropylmethyl(propyl)amino]-1-(4-fluorophenyl)ethanol
CID 110883262
2-[cyclopropylmethyl(methyl)amino]-1-phenylethanol
CID 60971117
2-(dipropylamino)-1-(4-phenylphenyl)ethanol
CID 82215884
(2R)-1-[cyclopropylmethyl(propyl)amino]propan-2-ol
CID 103935017
1-(4-aminophenyl)-2-[cyclopropylmethyl(ethyl)amino]ethanol
CID 63954700
1-[cyclopropylmethyl(propyl)amino]-3-(2-methylphenoxy)propan-2-ol
CID 78782947
[(1S)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethyl] carbamate;1,3-xylene
CID 142018139
1-(3-aminophenyl)-2-(dipropylamino)ethanol
CID 55055730
2-[butyl(cyclopropyl)amino]-1-phenylethanol
CID 60751435
2-[cyclopropylmethyl(ethyl)amino]-1-(3-methoxyphenyl)ethanol
CID 63954429
2-[furan-2-ylmethyl(propyl)amino]-1-phenylethanol
CID 42836985

Frequently Asked Questions

What is the IUPAC name of (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol?
The IUPAC name of (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol (CID 2416449) is (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol.
What is the SMILES notation for (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol?
The canonical SMILES for (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol is CCCN(CC1CC1)C[C@H](O)c1ccccc1.
What is the InChIKey of (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol?
The InChIKey is PFZDNVITBTUXLN-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-10-16(11-13-8-9-13)12-15(17)14-6-4-3-5-7-14/h3-7,13,15,17H,2,8-12H2,1H3/t15-/m0/s1.
What are the key properties of (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol?
(1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol has a molecular weight of 233.36 g/mol, XLogP of 2.84, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[cyclopropylmethyl(propyl)amino]-1-phenylethanol is sourced from PubChem (CID 2416449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).