N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine

C19H38N2 — CID 63493739

IUPACN,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1CN(C)C1CCCCC1C
InChIInChI=1S/C19H38N2/c1-5-16-11-12-18(20-6-2)17(13-16)14-21(4)19-10-8-7-9-15(19)3/h15-20H,5-14H2,1-4H3
InChIKeyIBHDMKYJWPKLPP-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.30
Rot. Bonds6

About N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine

N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine (PubChem CID 63493739) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine
PubChem CID63493739
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC NameN,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1CN(C)C1CCCCC1C
InChIInChI=1S/C19H38N2/c1-5-16-11-12-18(20-6-2)17(13-16)14-21(4)19-10-8-7-9-15(19)3/h15-20H,5-14H2,1-4H3
InChIKeyIBHDMKYJWPKLPP-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[2-(ethylamino)cyclopentyl]ethyl]-N,2-dimethylcyclohexan-1-amine
CID 79565613
2-[[methyl-(2-methylcyclohexyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 63493740
2-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-N,4-diethylcyclohexan-1-amine
CID 63493475
N-ethyl-N-[[5-ethyl-2-(ethylamino)cyclohexyl]methyl]aniline
CID 63482884
N-[[5-ethyl-2-(ethylamino)cyclohexyl]methyl]-N,3-dimethylaniline
CID 63494608
N,4-diethyl-2-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62609986
2-[[2-(ethylamino)cyclohexyl]methyl-methylamino]cyclohexan-1-ol
CID 102636948
2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,4-diethylcyclohexan-1-amine
CID 62611350
N,4-diethyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 79310261
N,4-diethyl-2-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 63274181
2-[[cyclopropyl(methyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 62616008
1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine
CID 63468495

Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine (CID 63493739) is N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine is CCNC1CCC(CC)CC1CN(C)C1CCCCC1C.
What is the InChIKey of N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is IBHDMKYJWPKLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-5-16-11-12-18(20-6-2)17(13-16)14-21(4)19-10-8-7-9-15(19)3/h15-20H,5-14H2,1-4H3.
What are the key properties of N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine?
N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 63493739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).