cyclohexadecen-1-amine

C16H31N — CID 175415425

IUPACcyclohexadecen-1-amine
SMILESNC1=CCCCCCCCCCCCCCC1
InChIInChI=1S/C16H31N/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h14H,1-13,15,17H2
InChIKeyWJGAJPDTXHINHL-UHFFFAOYSA-N
MW237.43 g/mol
LogP5.30
Rot. Bonds

About cyclohexadecen-1-amine

cyclohexadecen-1-amine (PubChem CID 175415425) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is cyclohexadecen-1-amine.

Molecular Properties

Compound Namecyclohexadecen-1-amine
PubChem CID175415425
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Namecyclohexadecen-1-amine
SMILESNC1=CCCCCCCCCCCCCCC1
InChIInChI=1S/C16H31N/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h14H,1-13,15,17H2
InChIKeyWJGAJPDTXHINHL-UHFFFAOYSA-N
XLogP5.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500237.43
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1E)-cyclotridecen-1-amine
CID 141088485
cyclohexen-1-amine;triethoxy(propyl)silane
CID 175073818
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
1-(cyclopenten-1-yl)cyclooctene
CID 91463872
(1Z)-cyclodecene-1,2-diamine
CID 89062858
(1E,3Z)-cycloocta-1,3-dien-1-amine
CID 22286865
cyclododecen-1-ylmethanamine
CID 70571219
(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene
CID 11792107
(1E)-1-iodocyclononene
CID 169083106
(1Z)-cyclododecen-1-ol
CID 69035385
cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane
CID 173167887

Frequently Asked Questions

What is the IUPAC name of cyclohexadecen-1-amine?
The IUPAC name of cyclohexadecen-1-amine (CID 175415425) is cyclohexadecen-1-amine.
What is the SMILES notation for cyclohexadecen-1-amine?
The canonical SMILES for cyclohexadecen-1-amine is NC1=CCCCCCCCCCCCCCC1.
What is the InChIKey of cyclohexadecen-1-amine?
The InChIKey is WJGAJPDTXHINHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h14H,1-13,15,17H2.
What are the key properties of cyclohexadecen-1-amine?
cyclohexadecen-1-amine has a molecular weight of 237.43 g/mol, XLogP of 5.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexadecen-1-amine is sourced from PubChem (CID 175415425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).