N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine

C20H23N — CID 43503137

IUPACN-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine
SMILESc1ccc2c(NC3CC4CC3C3CCCC43)cccc2c1
InChIInChI=1S/C20H23N/c1-2-7-16-13(5-1)6-3-10-19(16)21-20-12-14-11-18(20)17-9-4-8-15(14)17/h1-3,5-7,10,14-15,17-18,20-21H,4,8-9,11-12H2
InChIKeyNMDNANMSDLVGMJ-UHFFFAOYSA-N
MW277.41 g/mol
LogP5.08
Rot. Bonds2

About N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine

N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine (PubChem CID 43503137) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine.

Molecular Properties

Compound NameN-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine
PubChem CID43503137
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC NameN-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine
SMILESc1ccc2c(NC3CC4CC3C3CCCC43)cccc2c1
InChIInChI=1S/C20H23N/c1-2-7-16-13(5-1)6-3-10-19(16)21-20-12-14-11-18(20)17-9-4-8-15(14)17/h1-3,5-7,10,14-15,17-18,20-21H,4,8-9,11-12H2
InChIKeyNMDNANMSDLVGMJ-UHFFFAOYSA-N
XLogP5.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.41
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-[(dimethylamino)methyl]phenyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43750113
2-N,2-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,2-diamine
CID 43726475
2-(naphthalen-1-ylamino)cycloheptan-1-ol
CID 60897825
N-(2,3,4-trifluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 43503157
4-chloro-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
CID 83164717
N-(2,5-dimethylcyclohexyl)naphthalen-1-amine
CID 64776146
N-(2-methylsulfonylcyclopentyl)naphthalen-1-amine
CID 65046366
N-naphthalen-1-yl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82853527
3-N,3-N-dimethyl-1-N-(8-tricyclo[5.2.1.02,6]decanyl)benzene-1,3-diamine
CID 115376237
N-[2-methyl-4-[[3-methyl-4-(naphthalen-1-ylamino)cyclohexyl]methyl]cyclohexyl]naphthalen-1-amine
CID 139567562
N-(2-propylcyclohexyl)naphthalen-1-amine
CID 154951720
N-(5-bromo-2,4-difluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 102852658

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine?
The IUPAC name of N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine (CID 43503137) is N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine.
What is the SMILES notation for N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine?
The canonical SMILES for N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine is c1ccc2c(NC3CC4CC3C3CCCC43)cccc2c1.
What is the InChIKey of N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine?
The InChIKey is NMDNANMSDLVGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-2-7-16-13(5-1)6-3-10-19(16)21-20-12-14-11-18(20)17-9-4-8-15(14)17/h1-3,5-7,10,14-15,17-18,20-21H,4,8-9,11-12H2.
What are the key properties of N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine?
N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine has a molecular weight of 277.41 g/mol, XLogP of 5.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yltricyclo[5.2.1.02,6]decan-8-amine is sourced from PubChem (CID 43503137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).