N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine

C15H30N2 — CID 80997645

IUPACN-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine
SMILESCCNCC1CCC1N(C)C1CCCCC1C
InChIInChI=1S/C15H30N2/c1-4-16-11-13-9-10-15(13)17(3)14-8-6-5-7-12(14)2/h12-16H,4-11H2,1-3H3
InChIKeyXUOXXKSVDMGWSY-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds5

About N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine

N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine (PubChem CID 80997645) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine
PubChem CID80997645
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine
SMILESCCNCC1CCC1N(C)C1CCCCC1C
InChIInChI=1S/C15H30N2/c1-4-16-11-13-9-10-15(13)17(3)14-8-6-5-7-12(14)2/h12-16H,4-11H2,1-3H3
InChIKeyXUOXXKSVDMGWSY-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(tert-butylamino)methyl]cyclobutyl]-N,2-dimethylcyclohexan-1-amine
CID 81000066
N-[2-(ethylaminomethyl)cyclobutyl]-N,3-dimethylcyclohexan-1-amine
CID 80998764
N-[2-(ethylaminomethyl)cyclobutyl]-N,1-dimethylpiperidin-4-amine
CID 80998347
2-(ethylaminomethyl)-N-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 80999159
2-(ethylaminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)cyclobutan-1-amine
CID 80999197
2-N-ethyl-1-N,3,3-trimethyl-1-N-(2-methylcyclohexyl)cyclohexane-1,2-diamine
CID 79828933
trans-(1R,2R)-2-[methyl-(2-methylcyclohexyl)amino]cyclohexan-1-ol
CID 102732058
3-(ethylamino)-N-methyl-N-(2-methylcyclohexyl)propanamide
CID 62835112
2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine
CID 80996990
N-methyl-N-[2-[(propan-2-ylamino)methyl]cyclobutyl]cyclopentanamine
CID 80999304
trans-(1R,2R)-N,N-diethyl-2-methylcyclohexan-1-amine
CID 15852265
N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N-methylcycloheptanamine
CID 80999025

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine?
The IUPAC name of N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine (CID 80997645) is N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine?
The canonical SMILES for N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine is CCNCC1CCC1N(C)C1CCCCC1C.
What is the InChIKey of N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine?
The InChIKey is XUOXXKSVDMGWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-16-11-13-9-10-15(13)17(3)14-8-6-5-7-12(14)2/h12-16H,4-11H2,1-3H3.
What are the key properties of N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine?
N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)cyclobutyl]-N,2-dimethylcyclohexan-1-amine is sourced from PubChem (CID 80997645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).