N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline

C17H26N2 — CID 112678176

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline
SMILESCCC(NC)c1ccccc1N(CC1CC1)C1CC1
InChIInChI=1S/C17H26N2/c1-3-16(18-2)15-6-4-5-7-17(15)19(14-10-11-14)12-13-8-9-13/h4-7,13-14,16,18H,3,8-12H2,1-2H3
InChIKeyOUIUDGXEFQEZBR-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.74
Rot. Bonds7

About N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline

N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline (PubChem CID 112678176) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline
PubChem CID112678176
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline
SMILESCCC(NC)c1ccccc1N(CC1CC1)C1CC1
InChIInChI=1S/C17H26N2/c1-3-16(18-2)15-6-4-5-7-17(15)19(14-10-11-14)12-13-8-9-13/h4-7,13-14,16,18H,3,8-12H2,1-2H3
InChIKeyOUIUDGXEFQEZBR-UHFFFAOYSA-N
XLogP3.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[N-cyclopropyl-2-[1-(methylamino)propyl]anilino]ethanol
CID 112678034
N-cyclohexyl-N-methyl-2-[1-(methylamino)propyl]aniline
CID 112677774
N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
CID 112677823
N-cyclopropyl-2-[1-(ethylamino)propyl]-N-prop-2-enylaniline
CID 112678265
N-cyclopropyl-N-(cyclopropylmethyl)-6-[1-(methylamino)propyl]pyridin-3-amine
CID 112584477
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-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline
CID 115995005
1-[2-(4-ethylcyclohexyl)oxyphenyl]-N-methylpropan-1-amine
CID 64750411
N-methyl-2-[1-(methylamino)propyl]-N-(4-methylpentan-2-yl)aniline
CID 112678050
1-[2-[cyclopropyl(cyclopropylmethyl)amino]phenyl]ethanone
CID 64520568
5-bromo-N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)ethyl]aniline
CID 82968388

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline (CID 112678176) is N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline is CCC(NC)c1ccccc1N(CC1CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline?
The InChIKey is OUIUDGXEFQEZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-3-16(18-2)15-6-4-5-7-17(15)19(14-10-11-14)12-13-8-9-13/h4-7,13-14,16,18H,3,8-12H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline?
N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline has a molecular weight of 258.41 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline is sourced from PubChem (CID 112678176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).