N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline

C17H28N2 — CID 112677823

IUPACN-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
SMILESCCCNC(CC)c1ccccc1N(CC)C1CC1
InChIInChI=1S/C17H28N2/c1-4-13-18-16(5-2)15-9-7-8-10-17(15)19(6-3)14-11-12-14/h7-10,14,16,18H,4-6,11-13H2,1-3H3
InChIKeyIGXMTYAYLBCQLA-UHFFFAOYSA-N
MW260.43 g/mol
LogP4.13
Rot. Bonds8

About N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline

N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline (PubChem CID 112677823) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
PubChem CID112677823
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
SMILESCCCNC(CC)c1ccccc1N(CC)C1CC1
InChIInChI=1S/C17H28N2/c1-4-13-18-16(5-2)15-9-7-8-10-17(15)19(6-3)14-11-12-14/h7-10,14,16,18H,4-6,11-13H2,1-3H3
InChIKeyIGXMTYAYLBCQLA-UHFFFAOYSA-N
XLogP4.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline
CID 115995005
N-(cyclopropylmethyl)-N-methyl-2-[1-(propylamino)propyl]aniline
CID 112677945
(1S)-1-[2-[cyclopropyl(ethyl)amino]phenyl]propan-1-ol
CID 103959730
N-cyclopropyl-2-[1-(ethylamino)propyl]-N-prop-2-enylaniline
CID 112678265
N-butan-2-yl-N-methyl-2-[1-(propylamino)propyl]aniline
CID 112677858
N-methyl-N-[2-[2-[1-(propylamino)propyl]phenoxy]ethyl]cyclopropanamine
CID 102740250
N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline
CID 112678176
N,N,N'-trimethyl-N'-[2-[1-(propylamino)propyl]phenyl]ethane-1,2-diamine
CID 115995247
2-[N-cyclopropyl-2-[1-(methylamino)propyl]anilino]ethanol
CID 112678034
1-[N-ethyl-2-[1-(propylamino)propyl]anilino]-2-methylpropan-2-ol
CID 115995337
2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline
CID 103958535
1-(2-methoxyphenyl)-N-propylpropan-1-amine
CID 43279174

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline?
The IUPAC name of N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline (CID 112677823) is N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline is CCCNC(CC)c1ccccc1N(CC)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline?
The InChIKey is IGXMTYAYLBCQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-4-13-18-16(5-2)15-9-7-8-10-17(15)19(6-3)14-11-12-14/h7-10,14,16,18H,4-6,11-13H2,1-3H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline?
N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline has a molecular weight of 260.43 g/mol, XLogP of 4.13, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline is sourced from PubChem (CID 112677823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).