2,5-dimethylcyclohexan-1-amine;hydrobromide

C8H18BrN — CID 17138988

IUPAC2,5-dimethylcyclohexan-1-amine;hydrobromide
SMILESBr.CC1CCC(C)C(N)C1
InChIInChI=1S/C8H17N.BrH/c1-6-3-4-7(2)8(9)5-6;/h6-8H,3-5,9H2,1-2H3;1H
InChIKeyCEDUJFWNRPRCKE-UHFFFAOYSA-N
MW208.14 g/mol
LogP2.35
Rot. Bonds

About 2,5-dimethylcyclohexan-1-amine;hydrobromide

2,5-dimethylcyclohexan-1-amine;hydrobromide (PubChem CID 17138988) has the molecular formula C8H18BrN and a molecular weight of 208.14 g/mol. Its IUPAC name is 2,5-dimethylcyclohexan-1-amine;hydrobromide.

Molecular Properties

Compound Name2,5-dimethylcyclohexan-1-amine;hydrobromide
PubChem CID17138988
Molecular FormulaC8H18BrN
Molecular Weight208.14 g/mol
Exact Mass207.06
IUPAC Name2,5-dimethylcyclohexan-1-amine;hydrobromide
SMILESBr.CC1CCC(C)C(N)C1
InChIInChI=1S/C8H17N.BrH/c1-6-3-4-7(2)8(9)5-6;/h6-8H,3-5,9H2,1-2H3;1H
InChIKeyCEDUJFWNRPRCKE-UHFFFAOYSA-N
XLogP2.35
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.14
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2R,5R)-2,5-dimethylcyclohexan-1-amine
CID 15306003
cis-(1R,2S)-4-methylcyclohexane-1,2-diamine
CID 101451140
2,4-dimethylcyclohexan-1-amine
CID 14675373
(1R,2S,4R)-2,4-dimethylcyclopentan-1-amine
CID 134253027
4-methylcyclohexane-1,2-diamine;sulfuric acid
CID 11528700
(2R)-2-amino-4-methylcyclohexan-1-ol
CID 142197995
lithium 2,5-dimethylcyclohexan-1-ol
CID 18764144
2-(aminomethyl)-5-methylcyclohexan-1-amine
CID 62070304
(3R)-1,3-dimethylcyclopentane
CID 13119651
trans-(1R,2R)-2-methylcyclopropan-1-amine
CID 12953691
1,3,6,8-tetramethylcyclodecane
CID 162455053
1,2,4,7-tetramethylcyclononane
CID 123661715

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylcyclohexan-1-amine;hydrobromide?
The IUPAC name of 2,5-dimethylcyclohexan-1-amine;hydrobromide (CID 17138988) is 2,5-dimethylcyclohexan-1-amine;hydrobromide.
What is the SMILES notation for 2,5-dimethylcyclohexan-1-amine;hydrobromide?
The canonical SMILES for 2,5-dimethylcyclohexan-1-amine;hydrobromide is Br.CC1CCC(C)C(N)C1.
What is the InChIKey of 2,5-dimethylcyclohexan-1-amine;hydrobromide?
The InChIKey is CEDUJFWNRPRCKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.BrH/c1-6-3-4-7(2)8(9)5-6;/h6-8H,3-5,9H2,1-2H3;1H.
What are the key properties of 2,5-dimethylcyclohexan-1-amine;hydrobromide?
2,5-dimethylcyclohexan-1-amine;hydrobromide has a molecular weight of 208.14 g/mol, XLogP of 2.35, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylcyclohexan-1-amine;hydrobromide is sourced from PubChem (CID 17138988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).