3-methyl-5-phenyl-3-(propylamino)pentan-1-ol

C15H25NO — CID 65234500

IUPAC3-methyl-5-phenyl-3-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CCO)CCc1ccccc1
InChIInChI=1S/C15H25NO/c1-3-12-16-15(2,11-13-17)10-9-14-7-5-4-6-8-14/h4-8,16-17H,3,9-13H2,1-2H3
InChIKeyDVHMNXFQCPIDQY-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.76
Rot. Bonds8

About 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol

3-methyl-5-phenyl-3-(propylamino)pentan-1-ol (PubChem CID 65234500) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol.

Molecular Properties

Compound Name3-methyl-5-phenyl-3-(propylamino)pentan-1-ol
PubChem CID65234500
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name3-methyl-5-phenyl-3-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CCO)CCc1ccccc1
InChIInChI=1S/C15H25NO/c1-3-12-16-15(2,11-13-17)10-9-14-7-5-4-6-8-14/h4-8,16-17H,3,9-13H2,1-2H3
InChIKeyDVHMNXFQCPIDQY-UHFFFAOYSA-N
XLogP2.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(1-amino-2-methyl-4-phenylbutan-2-yl)amino]propan-1-ol
CID 65378027
4-(4-methoxyphenyl)-2-methyl-2-(propylamino)butan-1-ol
CID 61056815
2,2-dimethyl-4-phenylbutan-1-ol
CID 59141048
3-(ethylamino)-3-methyl-5-phenylpentanamide
CID 65233623
3-(ethylamino)-5-(4-methoxyphenyl)-3-methylpentan-1-ol
CID 65235107
2-(2-hydroxyethylamino)-2-methyl-4-phenylbutanoic acid
CID 114990394
4-[4-(difluoromethoxy)phenyl]-2-methyl-2-(propylamino)butan-1-ol
CID 61055180
3-phenyl-3-(propylamino)hexan-1-ol
CID 65234672
N-(2-methyl-4-phenylbutan-2-yl)hexan-1-amine
CID 113472369
4-[3-(benzylamino)-4-hydroxy-3-methylbutyl]phenol
CID 61046174
2,2-dimethyl-5-phenyl-N-propylpentan-1-amine
CID 55107021
3-[(2-methyl-4-phenylbutan-2-yl)amino]propane-1,2-diol
CID 12855751

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol?
The IUPAC name of 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol (CID 65234500) is 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol.
What is the SMILES notation for 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol?
The canonical SMILES for 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol is CCCNC(C)(CCO)CCc1ccccc1.
What is the InChIKey of 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol?
The InChIKey is DVHMNXFQCPIDQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-3-12-16-15(2,11-13-17)10-9-14-7-5-4-6-8-14/h4-8,16-17H,3,9-13H2,1-2H3.
What are the key properties of 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol?
3-methyl-5-phenyl-3-(propylamino)pentan-1-ol has a molecular weight of 235.37 g/mol, XLogP of 2.76, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenyl-3-(propylamino)pentan-1-ol is sourced from PubChem (CID 65234500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).