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

C18H30N2 — CID 43284184

IUPACN-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)C1CCCCC1
InChIInChI=1S/C18H30N2/c1-4-14-19-15(2)17-12-8-9-13-18(17)20(3)16-10-6-5-7-11-16/h8-9,12-13,15-16,19H,4-7,10-11,14H2,1-3H3
InChIKeyUUEFAIVCXTXNMT-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.52
Rot. Bonds6

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

N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline (PubChem CID 43284184) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline
PubChem CID43284184
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)C1CCCCC1
InChIInChI=1S/C18H30N2/c1-4-14-19-15(2)17-12-8-9-13-18(17)20(3)16-10-6-5-7-11-16/h8-9,12-13,15-16,19H,4-7,10-11,14H2,1-3H3
InChIKeyUUEFAIVCXTXNMT-UHFFFAOYSA-N
XLogP4.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[2-[1-(propylamino)ethyl]phenyl]cycloheptanamine
CID 43614164
N-cyclopentyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284594
N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline
CID 63532695
N-methyl-1,1-dioxo-N-[2-[1-(propylamino)ethyl]phenyl]thiolan-3-amine
CID 43648827
N,2-dimethyl-N-[2-[1-(propylamino)ethyl]phenyl]oxolan-3-amine
CID 82739333
N-[2-[(1S)-1-aminoethyl]phenyl]-N-methylcycloheptanamine
CID 55190297
N-cyclohexyl-N-methyl-2-[1-(methylamino)propyl]aniline
CID 112677774
2-[2-[1-(ethylamino)ethyl]-N-methylanilino]cyclohexan-1-ol
CID 102632638
N-ethyl-N-phenyl-2-[1-(propylamino)ethyl]aniline
CID 43284277
(1S)-1-[2-[cyclopentyl(methyl)amino]phenyl]ethanol
CID 63370690
N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284092
N-cyclopentyl-N-methyl-2-(propylaminomethyl)aniline
CID 43281753

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The IUPAC name of N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline (CID 43284184) is N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The canonical SMILES for N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline is CCCNC(C)c1ccccc1N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The InChIKey is UUEFAIVCXTXNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-14-19-15(2)17-12-8-9-13-18(17)20(3)16-10-6-5-7-11-16/h8-9,12-13,15-16,19H,4-7,10-11,14H2,1-3H3.
What are the key properties of N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline has a molecular weight of 274.45 g/mol, XLogP of 4.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline is sourced from PubChem (CID 43284184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).