N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine

C17H29N — CID 43392260

IUPACN-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESCC1CCCCC1NC1CC2CC1C1CCCC21
InChIInChI=1S/C17H29N/c1-11-5-2-3-8-16(11)18-17-10-12-9-15(17)14-7-4-6-13(12)14/h11-18H,2-10H2,1H3
InChIKeyLYVVOZLWFJAWPI-UHFFFAOYSA-N
MW247.43 g/mol
LogP3.98
Rot. Bonds2

About N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine

N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine (PubChem CID 43392260) has the molecular formula C17H29N and a molecular weight of 247.43 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine
PubChem CID43392260
Molecular FormulaC17H29N
Molecular Weight247.43 g/mol
Exact Mass247.23
IUPAC NameN-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESCC1CCCCC1NC1CC2CC1C1CCCC21
InChIInChI=1S/C17H29N/c1-11-5-2-3-8-16(11)18-17-10-12-9-15(17)14-7-4-6-13(12)14/h11-18H,2-10H2,1H3
InChIKeyLYVVOZLWFJAWPI-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.43
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-methylcyclopentyl]cyclohexan-1-amine
CID 124708997
1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidin-4-amine
CID 115714383
2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)oxolan-3-amine
CID 115337056
1-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidin-4-amine
CID 43392317
N-(3-methoxycyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 103904074
cis-(1S,2R)-2-[[(1R,2S)-2-methylcyclopentyl]amino]cyclohexan-1-ol
CID 95377487
N-(8-tricyclo[5.2.1.02,6]decanyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752241
2-methyl-N-(2-methylcyclohexyl)thian-3-amine
CID 79956809
2-methyl-N-(2-piperidin-2-ylcyclopentyl)cyclopentan-1-amine
CID 79545248
1,1-dimethyl-3-[(1R,7R,8R)-8-tricyclo[5.2.1.02,6]decanyl]thiourea
CID 102058374
(1R,2S,6R,7S,8R)-N-propyltricyclo[5.2.1.02,6]decan-8-amine
CID 124708771
N-(3-cyclopropylcyclohexyl)-2-methylcyclohexan-1-amine
CID 64596012

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine?
The IUPAC name of N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine (CID 43392260) is N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine.
What is the SMILES notation for N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine?
The canonical SMILES for N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine is CC1CCCCC1NC1CC2CC1C1CCCC21.
What is the InChIKey of N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine?
The InChIKey is LYVVOZLWFJAWPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N/c1-11-5-2-3-8-16(11)18-17-10-12-9-15(17)14-7-4-6-13(12)14/h11-18H,2-10H2,1H3.
What are the key properties of N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine?
N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine has a molecular weight of 247.43 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)tricyclo[5.2.1.02,6]decan-8-amine is sourced from PubChem (CID 43392260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).