N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol

C13H29NO — CID 71071729

IUPACN-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol
SMILESCCCO.CNC1CCCCC1C(C)C
InChIInChI=1S/C10H21N.C3H8O/c1-8(2)9-6-4-5-7-10(9)11-3;1-2-3-4/h8-11H,4-7H2,1-3H3;4H,2-3H2,1H3
InChIKeyKFPKWUOQXKZMTG-UHFFFAOYSA-N
MW215.38 g/mol
LogP2.81
Rot. Bonds3

About N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol

N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol (PubChem CID 71071729) has the molecular formula C13H29NO and a molecular weight of 215.38 g/mol. Its IUPAC name is N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol.

Molecular Properties

Compound NameN-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol
PubChem CID71071729
Molecular FormulaC13H29NO
Molecular Weight215.38 g/mol
Exact Mass215.22
IUPAC NameN-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol
SMILESCCCO.CNC1CCCCC1C(C)C
InChIInChI=1S/C10H21N.C3H8O/c1-8(2)9-6-4-5-7-10(9)11-3;1-2-3-4/h8-11H,4-7H2,1-3H3;4H,2-3H2,1H3
InChIKeyKFPKWUOQXKZMTG-UHFFFAOYSA-N
XLogP2.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.38
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-butan-2-yl-N-methylcyclooctan-1-amine;propan-1-ol
CID 71071601
2-butan-2-yl-N-methylcyclooctan-1-amine;ethanol
CID 71071102
2-propan-2-yl-N-propylcyclohexan-1-amine
CID 62603110
2-ethyl-N-methylcycloheptan-1-amine;propan-1-ol
CID 71071435
trans-(1R,2S)-2-propan-2-yl-N-[(1S,2S)-2-propan-2-ylcyclohexyl]cyclohexan-1-amine
CID 124709501
2-butyl-N-methylcyclohexan-1-amine;propan-1-ol
CID 71071796
N-fluoro-2-propan-2-ylcyclohexan-1-amine
CID 142212218
N-(2-methylpropyl)-2-propan-2-ylcyclohexan-1-amine
CID 81301790
N-ethoxy-2-propan-2-ylcyclohexan-1-amine
CID 82709453
N,2-di(propan-2-yl)cycloheptan-1-amine
CID 164647627
N-(2-propan-2-ylcyclohexyl)ethanesulfonamide
CID 59292409
cis-(1S,2R)-2-[(1S)-1-ethoxyethyl]-N-methylcyclopentan-1-amine
CID 177009821

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol?
The IUPAC name of N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol (CID 71071729) is N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol.
What is the SMILES notation for N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol?
The canonical SMILES for N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol is CCCO.CNC1CCCCC1C(C)C.
What is the InChIKey of N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol?
The InChIKey is KFPKWUOQXKZMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N.C3H8O/c1-8(2)9-6-4-5-7-10(9)11-3;1-2-3-4/h8-11H,4-7H2,1-3H3;4H,2-3H2,1H3.
What are the key properties of N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol?
N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol has a molecular weight of 215.38 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propan-2-ylcyclohexan-1-amine;propan-1-ol is sourced from PubChem (CID 71071729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).