N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine

C18H36N2O — CID 107395213

IUPACN,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1CN1CCCC(C)(OC)C1
InChIInChI=1S/C18H36N2O/c1-5-15-8-9-17(19-6-2)16(12-15)13-20-11-7-10-18(3,14-20)21-4/h15-17,19H,5-14H2,1-4H3
InChIKeyQEKQZGATBVVEAW-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.29
Rot. Bonds6

About N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine

N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine (PubChem CID 107395213) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
PubChem CID107395213
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC NameN,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1CN1CCCC(C)(OC)C1
InChIInChI=1S/C18H36N2O/c1-5-15-8-9-17(19-6-2)16(12-15)13-20-11-7-10-18(3,14-20)21-4/h15-17,19H,5-14H2,1-4H3
InChIKeyQEKQZGATBVVEAW-UHFFFAOYSA-N
XLogP3.29
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-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

N-ethyl-3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]oxan-4-amine
CID 107395161
N-ethyl-2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]cyclopentan-1-amine
CID 107391928
N,4-diethyl-2-(1,4-thiazepan-4-ylmethyl)cyclohexan-1-amine
CID 55094286
N-ethyl-4-propyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
CID 62616394
2-[4-[[5-ethyl-2-(ethylamino)cyclohexyl]methyl]piperazin-1-yl]ethanol
CID 62614447
N,4-diethyl-2-[(1-oxo-1,4-thiazinan-4-yl)methyl]cyclohexan-1-amine
CID 62610496
2-[(4,4-dimethylazepan-1-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 65282251
N,4-diethyl-2-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 63636012
2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol
CID 107395253
6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-2,2-dimethylcyclohexan-1-amine
CID 107395119
2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
CID 107392083
N-(cyclopropylmethyl)-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107393244

Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine (CID 107395213) is N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine is CCNC1CCC(CC)CC1CN1CCCC(C)(OC)C1.
What is the InChIKey of N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is QEKQZGATBVVEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-5-15-8-9-17(19-6-2)16(12-15)13-20-11-7-10-18(3,14-20)21-4/h15-17,19H,5-14H2,1-4H3.
What are the key properties of N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine?
N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 296.50 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 107395213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).