2-(cyclooctylamino)-3-methylpentan-1-ol

C14H29NO — CID 115891669

IUPAC2-(cyclooctylamino)-3-methylpentan-1-ol
SMILESCCC(C)C(CO)NC1CCCCCCC1
InChIInChI=1S/C14H29NO/c1-3-12(2)14(11-16)15-13-9-7-5-4-6-8-10-13/h12-16H,3-11H2,1-2H3
InChIKeyJYFDFPXTDPYEFF-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.10
Rot. Bonds5

About 2-(cyclooctylamino)-3-methylpentan-1-ol

2-(cyclooctylamino)-3-methylpentan-1-ol (PubChem CID 115891669) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-(cyclooctylamino)-3-methylpentan-1-ol.

Molecular Properties

Compound Name2-(cyclooctylamino)-3-methylpentan-1-ol
PubChem CID115891669
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-(cyclooctylamino)-3-methylpentan-1-ol
SMILESCCC(C)C(CO)NC1CCCCCCC1
InChIInChI=1S/C14H29NO/c1-3-12(2)14(11-16)15-13-9-7-5-4-6-8-10-13/h12-16H,3-11H2,1-2H3
InChIKeyJYFDFPXTDPYEFF-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-ethylcyclopentyl)amino]-3-methylpentan-1-ol
CID 115891675
(2S)-2-(cyclooctylamino)butan-1-ol
CID 28723227
2-(cyclododecylamino)propan-1-ol
CID 43499740
N-(3-ethylpentan-2-yl)cyclohexanamine
CID 63842425
1-(cyclopentylamino)ethanol
CID 18784157
2-(cyclopentylamino)-3-phenylbutan-1-ol
CID 61309786
[(3R)-3-methylpentan-2-yl]cyclopentane
CID 144516432
N-propan-2-ylcycloheptanamine
CID 42562651
1-(cyclohexylamino)ethane-1,2-diol
CID 123616579
2-cyclododecylpropan-1-ol;ethanol
CID 69400645
3-methyl-2-(oxepan-4-ylamino)butan-1-ol
CID 79254168
(2R)-2-cyclohexylpropan-1-ol
CID 10176192

Frequently Asked Questions

What is the IUPAC name of 2-(cyclooctylamino)-3-methylpentan-1-ol?
The IUPAC name of 2-(cyclooctylamino)-3-methylpentan-1-ol (CID 115891669) is 2-(cyclooctylamino)-3-methylpentan-1-ol.
What is the SMILES notation for 2-(cyclooctylamino)-3-methylpentan-1-ol?
The canonical SMILES for 2-(cyclooctylamino)-3-methylpentan-1-ol is CCC(C)C(CO)NC1CCCCCCC1.
What is the InChIKey of 2-(cyclooctylamino)-3-methylpentan-1-ol?
The InChIKey is JYFDFPXTDPYEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-12(2)14(11-16)15-13-9-7-5-4-6-8-10-13/h12-16H,3-11H2,1-2H3.
What are the key properties of 2-(cyclooctylamino)-3-methylpentan-1-ol?
2-(cyclooctylamino)-3-methylpentan-1-ol has a molecular weight of 227.39 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclooctylamino)-3-methylpentan-1-ol is sourced from PubChem (CID 115891669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).