N-cyclododecyloxan-4-amine

C17H33NO — CID 43609748

IUPACN-cyclododecyloxan-4-amine
SMILESC1CCCCCC(NC2CCOCC2)CCCCC1
InChIInChI=1S/C17H33NO/c1-2-4-6-8-10-16(11-9-7-5-3-1)18-17-12-14-19-15-13-17/h16-18H,1-15H2
InChIKeyPOLWLJCQXHCSJY-UHFFFAOYSA-N
MW267.46 g/mol
LogP4.43
Rot. Bonds2

About N-cyclododecyloxan-4-amine

N-cyclododecyloxan-4-amine (PubChem CID 43609748) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is N-cyclododecyloxan-4-amine.

Molecular Properties

Compound NameN-cyclododecyloxan-4-amine
PubChem CID43609748
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC NameN-cyclododecyloxan-4-amine
SMILESC1CCCCCC(NC2CCOCC2)CCCCC1
InChIInChI=1S/C17H33NO/c1-2-4-6-8-10-16(11-9-7-5-3-1)18-17-12-14-19-15-13-17/h16-18H,1-15H2
InChIKeyPOLWLJCQXHCSJY-UHFFFAOYSA-N
XLogP4.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclododecyloxan-4-amine 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

N-cyclopentyloxan-4-amine
CID 28694035
N-cyclooctyloxepan-4-amine
CID 65076823
N-cyclobutyloxan-4-amine;hydrochloride
CID 155970514
N-cyclobutyloxepan-4-amine
CID 65079311
(3R)-N-cyclohexyloxolan-3-amine;hydrochloride
CID 166178208
N-cyclopentyloxolan-3-amine
CID 63331713
N-cyclopropylcyclododecanamine
CID 16776852
N-cycloheptyloxan-3-amine
CID 63359772
N-cyclohexylcyclohexanamine;ethane
CID 67925930
cis-(1R,3S)-3-(oxan-4-ylamino)cyclohexan-1-ol
CID 93277667
N-(3-methylcyclobutyl)oxepan-4-amine
CID 115892454
N-cycloheptyl-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79897814

Frequently Asked Questions

What is the IUPAC name of N-cyclododecyloxan-4-amine?
The IUPAC name of N-cyclododecyloxan-4-amine (CID 43609748) is N-cyclododecyloxan-4-amine.
What is the SMILES notation for N-cyclododecyloxan-4-amine?
The canonical SMILES for N-cyclododecyloxan-4-amine is C1CCCCCC(NC2CCOCC2)CCCCC1.
What is the InChIKey of N-cyclododecyloxan-4-amine?
The InChIKey is POLWLJCQXHCSJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-2-4-6-8-10-16(11-9-7-5-3-1)18-17-12-14-19-15-13-17/h16-18H,1-15H2.
What are the key properties of N-cyclododecyloxan-4-amine?
N-cyclododecyloxan-4-amine has a molecular weight of 267.46 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclododecyloxan-4-amine is sourced from PubChem (CID 43609748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).