2-(2-aminopropyl)-N,N-dibutylaniline

C17H30N2 — CID 63786767

IUPAC2-(2-aminopropyl)-N,N-dibutylaniline
SMILESCCCCN(CCCC)c1ccccc1CC(C)N
InChIInChI=1S/C17H30N2/c1-4-6-12-19(13-7-5-2)17-11-9-8-10-16(17)14-15(3)18/h8-11,15H,4-7,12-14,18H2,1-3H3
InChIKeyRQYILFQUEOEKTL-UHFFFAOYSA-N
MW262.44 g/mol
LogP3.98
Rot. Bonds9

About 2-(2-aminopropyl)-N,N-dibutylaniline

2-(2-aminopropyl)-N,N-dibutylaniline (PubChem CID 63786767) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is 2-(2-aminopropyl)-N,N-dibutylaniline.

Molecular Properties

Compound Name2-(2-aminopropyl)-N,N-dibutylaniline
PubChem CID63786767
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC Name2-(2-aminopropyl)-N,N-dibutylaniline
SMILESCCCCN(CCCC)c1ccccc1CC(C)N
InChIInChI=1S/C17H30N2/c1-4-6-12-19(13-7-5-2)17-11-9-8-10-16(17)14-15(3)18/h8-11,15H,4-7,12-14,18H2,1-3H3
InChIKeyRQYILFQUEOEKTL-UHFFFAOYSA-N
XLogP3.98
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[2-(2-aminopropyl)phenyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 55236815
2-(2-aminobutyl)-N-butyl-N-ethylaniline
CID 63785761
1-(2-butylphenyl)propan-2-amine
CID 21117027
2-(2-aminopropyl)-N-ethyl-N-(2-methylbutyl)aniline
CID 79481188
N,N-dibutyl-2-propan-2-ylaniline
CID 67779975
1-N-butyl-1-N-phenylpropane-1,2-diamine
CID 64584797
2-[N-butyl-2-(hydroxymethyl)anilino]acetamide
CID 55003388
2-(2-aminopropyl)-N-(2-methoxyethyl)-N-pentan-3-ylaniline
CID 63816723
2-(2-aminobutyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)aniline
CID 63815111
4-(2-aminopropyl)-N-butyl-N-ethylaniline
CID 63786093
1-[2-(dibutylamino)phenyl]propan-1-ol
CID 22494911
2-(2-butoxy-5-tert-butyloctyl)-N,N-dibutylaniline
CID 141020309

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropyl)-N,N-dibutylaniline?
The IUPAC name of 2-(2-aminopropyl)-N,N-dibutylaniline (CID 63786767) is 2-(2-aminopropyl)-N,N-dibutylaniline.
What is the SMILES notation for 2-(2-aminopropyl)-N,N-dibutylaniline?
The canonical SMILES for 2-(2-aminopropyl)-N,N-dibutylaniline is CCCCN(CCCC)c1ccccc1CC(C)N.
What is the InChIKey of 2-(2-aminopropyl)-N,N-dibutylaniline?
The InChIKey is RQYILFQUEOEKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2/c1-4-6-12-19(13-7-5-2)17-11-9-8-10-16(17)14-15(3)18/h8-11,15H,4-7,12-14,18H2,1-3H3.
What are the key properties of 2-(2-aminopropyl)-N,N-dibutylaniline?
2-(2-aminopropyl)-N,N-dibutylaniline has a molecular weight of 262.44 g/mol, XLogP of 3.98, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropyl)-N,N-dibutylaniline is sourced from PubChem (CID 63786767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).