(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine

C10H21N — CID 153443781

IUPAC(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine
SMILESCC(C)[C@H]1CC[C@@H](N)C[C@H]1C
InChIInChI=1S/C10H21N/c1-7(2)10-5-4-9(11)6-8(10)3/h7-10H,4-6,11H2,1-3H3/t8-,9-,10-/m1/s1
InChIKeyZBVSFJOXSNRPKR-OPRDCNLKSA-N
MW155.28 g/mol
LogP2.41
Rot. Bonds1

About (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine

(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine (PubChem CID 153443781) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine
PubChem CID153443781
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine
SMILESCC(C)[C@H]1CC[C@@H](N)C[C@H]1C
InChIInChI=1S/C10H21N/c1-7(2)10-5-4-9(11)6-8(10)3/h7-10H,4-6,11H2,1-3H3/t8-,9-,10-/m1/s1
InChIKeyZBVSFJOXSNRPKR-OPRDCNLKSA-N
XLogP2.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine 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

trans-(1R,5R)-5-amino-2-propan-2-ylcyclohexan-1-ol
CID 130207945
(1R)-1-methyl-2-propan-2-ylcyclobutane
CID 158704963
(1S,3S,4R)-3-methyl-4-propan-2-ylcyclohexan-1-ol
CID 176720342
2,4-dimethyl-1-propan-2-ylcyclohexane;propane
CID 143365202
(3S)-3-propan-2-ylcyclopentan-1-amine
CID 140882360
5-ethyl-1-methyl-2-propan-2-ylcycloheptane
CID 123365042
(1S,2R,4S)-4-amino-2-methylcyclohexan-1-ol
CID 124537900
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
formamide;1-methyl-2-propan-2-ylcyclohexane
CID 174972223
1,4-dimethyl-2-propan-2-ylcyclopentane
CID 91513076
1,2-dimethyl-3-propan-2-ylcyclopentane
CID 544190

Frequently Asked Questions

What is the IUPAC name of (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine?
The IUPAC name of (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine (CID 153443781) is (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine is CC(C)[C@H]1CC[C@@H](N)C[C@H]1C.
What is the InChIKey of (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine?
The InChIKey is ZBVSFJOXSNRPKR-OPRDCNLKSA-N. The full InChI is InChI=1S/C10H21N/c1-7(2)10-5-4-9(11)6-8(10)3/h7-10H,4-6,11H2,1-3H3/t8-,9-,10-/m1/s1.
What are the key properties of (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine?
(1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R,4R)-3-methyl-4-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 153443781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).