(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine

C10H21N — CID 174078567

IUPAC(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine
SMILESC[C@@H]1CC[C@H](N(C)C)[C@H](C)C1
InChIInChI=1S/C10H21N/c1-8-5-6-10(11(3)4)9(2)7-8/h8-10H,5-7H2,1-4H3/t8-,9-,10+/m1/s1
InChIKeyWHEBPNFTRCQTBM-BBBLOLIVSA-N
MW155.28 g/mol
LogP2.37
Rot. Bonds1

About (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine

(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine (PubChem CID 174078567) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine.

Molecular Properties

Compound Name(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine
PubChem CID174078567
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine
SMILESC[C@@H]1CC[C@H](N(C)C)[C@H](C)C1
InChIInChI=1S/C10H21N/c1-8-5-6-10(11(3)4)9(2)7-8/h8-10H,5-7H2,1-4H3/t8-,9-,10+/m1/s1
InChIKeyWHEBPNFTRCQTBM-BBBLOLIVSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[4-(dimethylamino)-3-methylcyclohexyl]methyl]-N,N,2-trimethylcyclohexan-1-amine
CID 13387426
1,2,4,7-tetramethylcyclononane
CID 123661715
N,N,2-trimethylcyclopentan-1-amine
CID 23553747
(3R)-1,3-dimethylcyclopentane
CID 13119651
1,3,6,8-tetramethylcyclodecane
CID 162455053
N-(2,4-dimethylcyclohexyl)-N-(4-ethenylcyclohexyl)-2,4-dimethylcyclohexan-1-amine
CID 140571030
ethane;N,N,3-trimethylcyclopentan-1-amine
CID 91598782
N,2,4-trimethyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602724
N-(2,4-dimethylcyclohexyl)-N-ethylazetidin-3-amine
CID 66181449
(1R,2R,4S)-2,4-dimethylcyclohexane-1-carboxylic acid
CID 7375874
methane;1,2,4-trimethylcyclopentane
CID 157268000
(1S)-2,4-dimethylcyclohexan-1-ol
CID 143035345

Frequently Asked Questions

What is the IUPAC name of (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine?
The IUPAC name of (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine (CID 174078567) is (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine.
What is the SMILES notation for (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine?
The canonical SMILES for (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine is C[C@@H]1CC[C@H](N(C)C)[C@H](C)C1.
What is the InChIKey of (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine?
The InChIKey is WHEBPNFTRCQTBM-BBBLOLIVSA-N. The full InChI is InChI=1S/C10H21N/c1-8-5-6-10(11(3)4)9(2)7-8/h8-10H,5-7H2,1-4H3/t8-,9-,10+/m1/s1.
What are the key properties of (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine?
(1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,4R)-N,N,2,4-tetramethylcyclohexan-1-amine is sourced from PubChem (CID 174078567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).