2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine

C17H36N2 — CID 55197305

IUPAC2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(C(C)C)CC1CN(CC)CC
InChIInChI=1S/C17H36N2/c1-6-11-18-17-10-9-15(14(4)5)12-16(17)13-19(7-2)8-3/h14-18H,6-13H2,1-5H3
InChIKeyNSUBNAGSVJYJPL-UHFFFAOYSA-N
MW268.49 g/mol
LogP3.77
Rot. Bonds8

About 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine

2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine (PubChem CID 55197305) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
PubChem CID55197305
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(C(C)C)CC1CN(CC)CC
InChIInChI=1S/C17H36N2/c1-6-11-18-17-10-9-15(14(4)5)12-16(17)13-19(7-2)8-3/h14-18H,6-13H2,1-5H3
InChIKeyNSUBNAGSVJYJPL-UHFFFAOYSA-N
XLogP3.77
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

N-ethyl-2-[[ethyl(propyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63483436
2-[[methyl(pentyl)amino]methyl]-4-propan-2-yl-N-propylcyclohexan-1-amine
CID 63482926
2-(2-methylbutyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
CID 63401154
2-(4-methylpentyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
CID 83158482
2-(2-methoxyethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine
CID 62740231
2-[[cyclopropylmethyl(ethyl)amino]methyl]-N-methyl-4-propan-2-ylcyclohexan-1-amine
CID 63957118
2-[[2-ethoxyethyl(ethyl)amino]methyl]-N-ethyl-4-propan-2-ylcyclohexan-1-amine
CID 63690532
2-[[cyclobutylmethyl(ethyl)amino]methyl]-N-methyl-4-propan-2-ylcyclohexan-1-amine
CID 107401543
4-ethyl-2-[[ethyl(propyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63483081
2-N-cyclopentyl-2-N-methyl-4-propan-2-yl-1-N-propylcyclohexane-1,2-diamine
CID 63466974
2-[[cyclobutylmethyl(ethyl)amino]methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 107401526
2-[[ethyl(2-methoxyethyl)amino]methyl]-N-methyl-4-propan-2-ylcyclohexan-1-amine
CID 55106257

Frequently Asked Questions

What is the IUPAC name of 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine?
The IUPAC name of 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine (CID 55197305) is 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine?
The canonical SMILES for 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine is CCCNC1CCC(C(C)C)CC1CN(CC)CC.
What is the InChIKey of 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine?
The InChIKey is NSUBNAGSVJYJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-6-11-18-17-10-9-15(14(4)5)12-16(17)13-19(7-2)8-3/h14-18H,6-13H2,1-5H3.
What are the key properties of 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine?
2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine has a molecular weight of 268.49 g/mol, XLogP of 3.77, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylaminomethyl)-4-propan-2-yl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 55197305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).