1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol

C19H39NO — CID 114952592

IUPAC1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESCCCCCCCCCCCCN(C)CC1(O)CCCC1
InChIInChI=1S/C19H39NO/c1-3-4-5-6-7-8-9-10-11-14-17-20(2)18-19(21)15-12-13-16-19/h21H,3-18H2,1-2H3
InChIKeyGOXBPMWOKHHRRN-UHFFFAOYSA-N
MW297.53 g/mol
LogP5.14
Rot. Bonds13

About 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol

1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol (PubChem CID 114952592) has the molecular formula C19H39NO and a molecular weight of 297.53 g/mol. Its IUPAC name is 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol
PubChem CID114952592
Molecular FormulaC19H39NO
Molecular Weight297.53 g/mol
Exact Mass297.30
IUPAC Name1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol
SMILESCCCCCCCCCCCCN(C)CC1(O)CCCC1
InChIInChI=1S/C19H39NO/c1-3-4-5-6-7-8-9-10-11-14-17-20(2)18-19(21)15-12-13-16-19/h21H,3-18H2,1-2H3
InChIKeyGOXBPMWOKHHRRN-UHFFFAOYSA-N
XLogP5.14
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.53
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol 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-[[6-hydroxyhexyl(methyl)amino]methyl]cyclopentan-1-ol
CID 103839075
1-[[3-ethylsulfonylpropyl(methyl)amino]methyl]cyclopentan-1-ol
CID 113321852
1-[[3-(ethylamino)propyl-methylamino]methyl]cyclopentan-1-ol
CID 114952474
1-[[methyl(2-propoxyethyl)amino]methyl]cyclopentan-1-ol
CID 106456276
1-[[methyl(pentyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62278291
1-[(dimethylamino)methyl]cycloheptan-1-ol
CID 104550048
4-[[5-hydroxypentyl(methyl)amino]methyl]oxan-4-ol
CID 114951905
1-octadecylcyclohexan-1-ol
CID 67204292
1-heptylcycloheptan-1-ol
CID 57057960
N-methyl-N-nonylundecan-1-amine
CID 603442
N-methyl-N-octadecyloctadecan-1-amine;N-methyl-N-tetradecyltetradecan-1-amine
CID 172776346
N-hexyl-N-methyldodecan-1-amine
CID 139978744

Frequently Asked Questions

What is the IUPAC name of 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol (CID 114952592) is 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol is CCCCCCCCCCCCN(C)CC1(O)CCCC1.
What is the InChIKey of 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is GOXBPMWOKHHRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39NO/c1-3-4-5-6-7-8-9-10-11-14-17-20(2)18-19(21)15-12-13-16-19/h21H,3-18H2,1-2H3.
What are the key properties of 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol?
1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 297.53 g/mol, XLogP of 5.14, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 114952592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).