N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine

C16H21N — CID 103903524

IUPACN-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESC1=CC(NC2CCc3ccccc3C2)CCC1
InChIInChI=1S/C16H21N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h2,4-8,15-17H,1,3,9-12H2
InChIKeyPELUBZAHSJBLRW-UHFFFAOYSA-N
MW227.35 g/mol
LogP3.24
Rot. Bonds2

About N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine

N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 103903524) has the molecular formula C16H21N and a molecular weight of 227.35 g/mol. Its IUPAC name is N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID103903524
Molecular FormulaC16H21N
Molecular Weight227.35 g/mol
Exact Mass227.17
IUPAC NameN-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESC1=CC(NC2CCc3ccccc3C2)CCC1
InChIInChI=1S/C16H21N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h2,4-8,15-17H,1,3,9-12H2
InChIKeyPELUBZAHSJBLRW-UHFFFAOYSA-N
XLogP3.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63277998
N-cyclohex-2-en-1-ylcyclooctanamine
CID 103830652
N-(3-propan-2-ylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107448472
4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]cyclohexan-1-ol
CID 26458441
4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]cyclohexan-1-ol
CID 26458443
N-(4-methylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43223234
N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 60664553
N-(cyclobutylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43775224
N-(2-tert-butylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43223738
N-(3-propan-2-ylcyclobutyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 103561864
1,1-dioxo-4-(1,2,3,4-tetrahydronaphthalen-2-ylamino)thiolan-3-ol
CID 55024632
N-(2,4-dimethylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63995066

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 103903524) is N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine is C1=CC(NC2CCc3ccccc3C2)CCC1.
What is the InChIKey of N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is PELUBZAHSJBLRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h2,4-8,15-17H,1,3,9-12H2.
What are the key properties of N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 227.35 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 103903524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).