N,3-dimethylcyclohexan-1-amine

C8H17N — CID 16771259

IUPACN,3-dimethylcyclohexan-1-amine
SMILESCNC1CCCC(C)C1
InChIInChI=1S/C8H17N/c1-7-4-3-5-8(6-7)9-2/h7-9H,3-6H2,1-2H3
InChIKeyBQHWWDQRAMXLHH-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.78
Rot. Bonds1

About N,3-dimethylcyclohexan-1-amine

N,3-dimethylcyclohexan-1-amine (PubChem CID 16771259) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is N,3-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN,3-dimethylcyclohexan-1-amine
PubChem CID16771259
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC NameN,3-dimethylcyclohexan-1-amine
SMILESCNC1CCCC(C)C1
InChIInChI=1S/C8H17N/c1-7-4-3-5-8(6-7)9-2/h7-9H,3-6H2,1-2H3
InChIKeyBQHWWDQRAMXLHH-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,3-dimethylcyclohexan-1-amine;hydrochloride
CID 45286057
trans-(1R,3R)-3-methyl-N-[(1S,3S)-3-methylcyclohexyl]cyclohexan-1-amine
CID 99646097
ethane;N-(3-methylcyclohexyl)formamide
CID 145231025
N-methyl-3-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64717554
(1R)-1,3-dimethylcyclohexane
CID 12594306
N-[di(cyclobutyl)methyl]-3-methylcyclohexan-1-amine
CID 112743180
cis-(1R,3S)-3-methyl-N-propylcyclohexan-1-amine
CID 15350394
N-[(3S)-3-methylcyclohexyl]acetamide
CID 143244343
(3-methylcyclohexyl)carbamic acid
CID 67410451
CID 175388606
CID 175388606
N-methyl-3-(3-methylcyclohexyl)sulfinylcyclopentan-1-amine
CID 64724266
N-(2-cyclopropylpropan-2-yl)-3-methylcyclohexan-1-amine
CID 103923064

Frequently Asked Questions

What is the IUPAC name of N,3-dimethylcyclohexan-1-amine?
The IUPAC name of N,3-dimethylcyclohexan-1-amine (CID 16771259) is N,3-dimethylcyclohexan-1-amine.
What is the SMILES notation for N,3-dimethylcyclohexan-1-amine?
The canonical SMILES for N,3-dimethylcyclohexan-1-amine is CNC1CCCC(C)C1.
What is the InChIKey of N,3-dimethylcyclohexan-1-amine?
The InChIKey is BQHWWDQRAMXLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-7-4-3-5-8(6-7)9-2/h7-9H,3-6H2,1-2H3.
What are the key properties of N,3-dimethylcyclohexan-1-amine?
N,3-dimethylcyclohexan-1-amine has a molecular weight of 127.23 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethylcyclohexan-1-amine is sourced from PubChem (CID 16771259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).