1-[(dodecylamino)methyl]cyclopentan-1-ol

C18H37NO — CID 65108837

IUPAC1-[(dodecylamino)methyl]cyclopentan-1-ol
SMILESCCCCCCCCCCCCNCC1(O)CCCC1
InChIInChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-13-16-19-17-18(20)14-11-12-15-18/h19-20H,2-17H2,1H3
InChIKeyKRXKAFYBJAWBEB-UHFFFAOYSA-N
MW283.50 g/mol
LogP4.80
Rot. Bonds13

About 1-[(dodecylamino)methyl]cyclopentan-1-ol

1-[(dodecylamino)methyl]cyclopentan-1-ol (PubChem CID 65108837) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 1-[(dodecylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(dodecylamino)methyl]cyclopentan-1-ol
PubChem CID65108837
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name1-[(dodecylamino)methyl]cyclopentan-1-ol
SMILESCCCCCCCCCCCCNCC1(O)CCCC1
InChIInChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-13-16-19-17-18(20)14-11-12-15-18/h19-20H,2-17H2,1H3
InChIKeyKRXKAFYBJAWBEB-UHFFFAOYSA-N
XLogP4.80
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(octylamino)methyl]cyclohexan-1-ol
CID 65106974
1-(butylaminomethyl)cyclopropan-1-ol
CID 89141441
1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol
CID 65111515
4-[(pentylamino)methyl]piperidin-4-ol
CID 95438274
1-[(decylamino)methyl]-3-methylcyclohexan-1-ol
CID 65120821
1-[(4-hydroxybutylamino)methyl]cyclopentan-1-ol
CID 65108735
1-[(2-butoxyethylamino)methyl]cyclopentan-1-ol
CID 65108781
1-[(4-hydroxybutylamino)methyl]cycloheptan-1-ol
CID 65122781
[1-[(hexylamino)methyl]cyclopentyl]methanol
CID 115358683
1-[[3-(dimethylamino)propylamino]methyl]cyclopentan-1-ol
CID 65211357
5-[(1-hydroxycycloheptyl)methylamino]pentanenitrile
CID 65123008
1-[(hept-6-enylamino)methyl]cycloheptan-1-ol
CID 107006904

Frequently Asked Questions

What is the IUPAC name of 1-[(dodecylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(dodecylamino)methyl]cyclopentan-1-ol (CID 65108837) is 1-[(dodecylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(dodecylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(dodecylamino)methyl]cyclopentan-1-ol is CCCCCCCCCCCCNCC1(O)CCCC1.
What is the InChIKey of 1-[(dodecylamino)methyl]cyclopentan-1-ol?
The InChIKey is KRXKAFYBJAWBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-13-16-19-17-18(20)14-11-12-15-18/h19-20H,2-17H2,1H3.
What are the key properties of 1-[(dodecylamino)methyl]cyclopentan-1-ol?
1-[(dodecylamino)methyl]cyclopentan-1-ol has a molecular weight of 283.50 g/mol, XLogP of 4.80, 13 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(dodecylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65108837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).