2-methyl-1-pentan-2-ylcyclohexan-1-amine

C12H25N — CID 107892270

IUPAC2-methyl-1-pentan-2-ylcyclohexan-1-amine
SMILESCCCC(C)C1(N)CCCCC1C
InChIInChI=1S/C12H25N/c1-4-7-10(2)12(13)9-6-5-8-11(12)3/h10-11H,4-9,13H2,1-3H3
InChIKeySZHBDWNSYNHTRS-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.33
Rot. Bonds3

About 2-methyl-1-pentan-2-ylcyclohexan-1-amine

2-methyl-1-pentan-2-ylcyclohexan-1-amine (PubChem CID 107892270) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2-methyl-1-pentan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-1-pentan-2-ylcyclohexan-1-amine
PubChem CID107892270
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2-methyl-1-pentan-2-ylcyclohexan-1-amine
SMILESCCCC(C)C1(N)CCCCC1C
InChIInChI=1S/C12H25N/c1-4-7-10(2)12(13)9-6-5-8-11(12)3/h10-11H,4-9,13H2,1-3H3
InChIKeySZHBDWNSYNHTRS-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dimethyl-1-pentan-2-ylcyclohexan-1-amine
CID 107892414
pentan-2-yl 1-amino-2-methylcyclohexane-1-carboxylate
CID 102982441
2-methyl-1-pentan-2-ylcyclopentane-1-carbonitrile
CID 130834446
1-ethyl-1-heptan-4-yl-2-methylcyclodecane
CID 123827321
3,4-dimethyl-1-pentan-2-ylcyclohexan-1-amine
CID 107892409
2-pentan-2-ylbicyclo[2.2.1]heptan-2-amine
CID 107898475
1,2,2,3-tetramethyl-1-pentan-2-ylcyclopentane
CID 123500106
1-butyl-2-methyl-1-octan-2-ylcyclohexane
CID 163529838
1,2-dimethyl-1-pentan-2-ylcyclopropane
CID 91541433
1-butyl-2-methyl-1-propan-2-ylcyclohexane
CID 174787138
2-methyl-1-propan-2-ylcyclobutan-1-amine
CID 57373673
2-methyl-1-(2-methyl-1-propylcyclohexyl)sulfanyl-1-propylcyclohexane
CID 141375882

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-pentan-2-ylcyclohexan-1-amine?
The IUPAC name of 2-methyl-1-pentan-2-ylcyclohexan-1-amine (CID 107892270) is 2-methyl-1-pentan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 2-methyl-1-pentan-2-ylcyclohexan-1-amine?
The canonical SMILES for 2-methyl-1-pentan-2-ylcyclohexan-1-amine is CCCC(C)C1(N)CCCCC1C.
What is the InChIKey of 2-methyl-1-pentan-2-ylcyclohexan-1-amine?
The InChIKey is SZHBDWNSYNHTRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-4-7-10(2)12(13)9-6-5-8-11(12)3/h10-11H,4-9,13H2,1-3H3.
What are the key properties of 2-methyl-1-pentan-2-ylcyclohexan-1-amine?
2-methyl-1-pentan-2-ylcyclohexan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-pentan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 107892270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).