N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline

C19H32N2 — CID 63532695

IUPACN-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)C1CCCCC1C
InChIInChI=1S/C19H32N2/c1-5-14-20-16(3)17-11-7-9-13-19(17)21(4)18-12-8-6-10-15(18)2/h7,9,11,13,15-16,18,20H,5-6,8,10,12,14H2,1-4H3
InChIKeyIBNBIZIJLDPBKU-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.76
Rot. Bonds6

About N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline

N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline (PubChem CID 63532695) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline
PubChem CID63532695
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)C1CCCCC1C
InChIInChI=1S/C19H32N2/c1-5-14-20-16(3)17-11-7-9-13-19(17)21(4)18-12-8-6-10-15(18)2/h7,9,11,13,15-16,18,20H,5-6,8,10,12,14H2,1-4H3
InChIKeyIBNBIZIJLDPBKU-UHFFFAOYSA-N
XLogP4.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284594
N-methyl-N-[2-[1-(propylamino)ethyl]phenyl]cycloheptanamine
CID 43614164
N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284184
N,2-dimethyl-N-[2-[1-(propylamino)ethyl]phenyl]oxolan-3-amine
CID 82739333
2-[(1R)-1-aminoethyl]-N-methyl-N-(2-methylcyclohexyl)aniline
CID 78935534
2-[2-[1-(ethylamino)ethyl]-N-methylanilino]cyclohexan-1-ol
CID 102632638
N-methyl-1,1-dioxo-N-[2-[1-(propylamino)ethyl]phenyl]thiolan-3-amine
CID 43648827
2-[1-(ethylamino)ethyl]-5-[methyl-(2-methylcyclohexyl)amino]phenol
CID 79590748
N-ethyl-N-phenyl-2-[1-(propylamino)ethyl]aniline
CID 43284277
N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284092
2-[(tert-butylamino)methyl]-N-methyl-N-(2-methylcyclohexyl)aniline
CID 63551947
N,N-bis(prop-2-enyl)-2-[1-(propylamino)ethyl]aniline
CID 43283869

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline (CID 63532695) is N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline is CCCNC(C)c1ccccc1N(C)C1CCCCC1C.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline?
The InChIKey is IBNBIZIJLDPBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-14-20-16(3)17-11-7-9-13-19(17)21(4)18-12-8-6-10-15(18)2/h7,9,11,13,15-16,18,20H,5-6,8,10,12,14H2,1-4H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline?
N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline has a molecular weight of 288.48 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline is sourced from PubChem (CID 63532695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).