N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine

C17H25N — CID 43094582

IUPACN-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
SMILESc1ccc2c(c1)CCCCC2NC1CCCCC1
InChIInChI=1S/C17H25N/c1-2-10-15(11-3-1)18-17-13-7-5-9-14-8-4-6-12-16(14)17/h4,6,8,12,15,17-18H,1-3,5,7,9-11,13H2
InChIKeyOIEGTKMPKOYYSR-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.38
Rot. Bonds2

About N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine

N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine (PubChem CID 43094582) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine.

Molecular Properties

Compound NameN-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
PubChem CID43094582
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC NameN-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
SMILESc1ccc2c(c1)CCCCC2NC1CCCCC1
InChIInChI=1S/C17H25N/c1-2-10-15(11-3-1)18-17-13-7-5-9-14-8-4-6-12-16(14)17/h4,6,8,12,15,17-18H,1-3,5,7,9-11,13H2
InChIKeyOIEGTKMPKOYYSR-UHFFFAOYSA-N
XLogP4.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopentyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43095434
N-cyclohexyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43080330
N-cyclopent-3-en-1-yl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 115695313
4-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)cyclohexane-1-carboxylic acid
CID 65054525
N-methyl-5,6,7,8,9,10-hexahydrobenzo[8]annulen-5-amine
CID 123748338
N-(4-propan-2-ylcycloheptyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65087328
N-cycloheptyl-2,3,4,5-tetrahydro-1H-2-benzazepin-5-amine
CID 103980640
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-dithiepan-6-amine
CID 131929126
N-(1,2,3,4-tetrahydronaphthalen-1-yl)oxolan-3-amine
CID 63331677
N-(3,4-dimethylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64731805
N-(3,3,5,5-tetramethylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115998636
N-(2-phenylcyclopropyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63454712

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine?
The IUPAC name of N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine (CID 43094582) is N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine.
What is the SMILES notation for N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine?
The canonical SMILES for N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine is c1ccc2c(c1)CCCCC2NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine?
The InChIKey is OIEGTKMPKOYYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-2-10-15(11-3-1)18-17-13-7-5-9-14-8-4-6-12-16(14)17/h4,6,8,12,15,17-18H,1-3,5,7,9-11,13H2.
What are the key properties of N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine?
N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine has a molecular weight of 243.39 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine is sourced from PubChem (CID 43094582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).