N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane

C13H29N — CID 169113778

IUPACN,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane
SMILESCC.CC(C)C1CCC(N(C)C)CC1
InChIInChI=1S/C11H23N.C2H6/c1-9(2)10-5-7-11(8-6-10)12(3)4;1-2/h9-11H,5-8H2,1-4H3;1-2H3
InChIKeyJUBCDQPVUUENOQ-UHFFFAOYSA-N
MW199.38 g/mol
LogP3.79
Rot. Bonds2

About N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane

N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane (PubChem CID 169113778) has the molecular formula C13H29N and a molecular weight of 199.38 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane
PubChem CID169113778
Molecular FormulaC13H29N
Molecular Weight199.38 g/mol
Exact Mass199.23
IUPAC NameN,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane
SMILESCC.CC(C)C1CCC(N(C)C)CC1
InChIInChI=1S/C11H23N.C2H6/c1-9(2)10-5-7-11(8-6-10)12(3)4;1-2/h9-11H,5-8H2,1-4H3;1-2H3
InChIKeyJUBCDQPVUUENOQ-UHFFFAOYSA-N
XLogP3.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.38
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane 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

N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;4-propan-2-yloxane
CID 158111671
propan-2-ylcyclopropane;hydroiodide
CID 162314014
4-N-methyl-4-N-(4-propan-2-ylcyclohexyl)cyclohexane-1,4-diamine
CID 79121688
N,N-dimethylcyclobutanamine;N,N-dimethylmethanamine;ethane
CID 143754899
4-(1-iodopropyl)-N,N-dimethylcyclohexan-1-amine
CID 142071347
1-[4-(dimethylamino)cyclohexyl]propan-1-ol
CID 123513782
4-N,4-N-dimethyl-1-N-propan-2-ylcyclohexane-1,4-diamine
CID 66569320
methane;N,N,4-trimethylcyclohexan-1-amine
CID 159051583
1-(difluoromethyl)-4-propan-2-ylcyclohexane;ethane
CID 167456625
1-N-(1-cyclopropylethyl)-3-N,3-N-dimethylcyclopentane-1,3-diamine
CID 115897235
4-N,4-N-dimethylcyclohexane-1,4-diamine;dihydrate
CID 175142686
4-(dimethylamino)cyclohexan-1-ol;vanadium
CID 176696741

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane?
The IUPAC name of N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane (CID 169113778) is N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane.
What is the SMILES notation for N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane?
The canonical SMILES for N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane is CC.CC(C)C1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane?
The InChIKey is JUBCDQPVUUENOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.C2H6/c1-9(2)10-5-7-11(8-6-10)12(3)4;1-2/h9-11H,5-8H2,1-4H3;1-2H3.
What are the key properties of N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane?
N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane has a molecular weight of 199.38 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-ylcyclohexan-1-amine;ethane is sourced from PubChem (CID 169113778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).