5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol

C19H33NO — CID 139814433

IUPAC5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol
SMILESCCCCC(O)(CCCC)C(CCc1ccccc1)NC
InChIInChI=1S/C19H33NO/c1-4-6-15-19(21,16-7-5-2)18(20-3)14-13-17-11-9-8-10-12-17/h8-12,18,20-21H,4-7,13-16H2,1-3H3
InChIKeyMLDLJNCORARSGZ-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.32
Rot. Bonds11

About 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol

5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol (PubChem CID 139814433) has the molecular formula C19H33NO and a molecular weight of 291.48 g/mol. Its IUPAC name is 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol.

Molecular Properties

Compound Name5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol
PubChem CID139814433
Molecular FormulaC19H33NO
Molecular Weight291.48 g/mol
Exact Mass291.26
IUPAC Name5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol
SMILESCCCCC(O)(CCCC)C(CCc1ccccc1)NC
InChIInChI=1S/C19H33NO/c1-4-6-15-19(21,16-7-5-2)18(20-3)14-13-17-11-9-8-10-12-17/h8-12,18,20-21H,4-7,13-16H2,1-3H3
InChIKeyMLDLJNCORARSGZ-UHFFFAOYSA-N
XLogP4.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(1S)-2-phenyl-1-(propan-2-ylamino)ethyl]nonan-5-ol
CID 101471980
4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine
CID 79060132
4-ethoxy-N,4-dimethyl-1-phenylhexan-3-amine
CID 116758710
1-phenylheptan-3-ol
CID 10420110
3-ethyl-2-methyl-6-phenylhexan-3-ol
CID 65146545
(1R)-1-(methylamino)-3-phenylpropan-1-ol
CID 67675162
N-methyl-1,5-diphenylpentan-3-amine
CID 10586995
tert-butyl N-(3-butyl-3-hydroxy-1-phenylheptan-2-yl)carbamate
CID 174995106
2-methyl-1-(4-phenylbutan-2-ylamino)pentan-2-ol
CID 103729692
butylbenzene;hydroxylamine
CID 175142403
hexylbenzene;hydrogen peroxide
CID 90001206
4-methyl-1-phenylheptan-4-ol
CID 67874665

Frequently Asked Questions

What is the IUPAC name of 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol?
The IUPAC name of 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol (CID 139814433) is 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol.
What is the SMILES notation for 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol?
The canonical SMILES for 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol is CCCCC(O)(CCCC)C(CCc1ccccc1)NC.
What is the InChIKey of 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol?
The InChIKey is MLDLJNCORARSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NO/c1-4-6-15-19(21,16-7-5-2)18(20-3)14-13-17-11-9-8-10-12-17/h8-12,18,20-21H,4-7,13-16H2,1-3H3.
What are the key properties of 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol?
5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol has a molecular weight of 291.48 g/mol, XLogP of 4.32, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol is sourced from PubChem (CID 139814433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).