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

C18H30N2O — CID 115995005

IUPACN-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline
SMILESCCCNC(CC)c1ccccc1N(CCOC)C1CC1
InChIInChI=1S/C18H30N2O/c1-4-12-19-17(5-2)16-8-6-7-9-18(16)20(13-14-21-3)15-10-11-15/h6-9,15,17,19H,4-5,10-14H2,1-3H3
InChIKeyPFCYZTRUNKZZCZ-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.75
Rot. Bonds10

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

N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline (PubChem CID 115995005) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline
PubChem CID115995005
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline
SMILESCCCNC(CC)c1ccccc1N(CCOC)C1CC1
InChIInChI=1S/C18H30N2O/c1-4-12-19-17(5-2)16-8-6-7-9-18(16)20(13-14-21-3)15-10-11-15/h6-9,15,17,19H,4-5,10-14H2,1-3H3
InChIKeyPFCYZTRUNKZZCZ-UHFFFAOYSA-N
XLogP3.75
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
CID 112677823
N-(3-methoxypropyl)-N-methyl-2-[1-(propylamino)propyl]aniline
CID 115995187
N-methyl-N-[2-[2-[1-(propylamino)propyl]phenoxy]ethyl]cyclopropanamine
CID 102740250
2-[N-cyclopropyl-2-[1-(methylamino)propyl]anilino]ethanol
CID 112678034
N-(cyclopropylmethyl)-N-methyl-2-[1-(propylamino)propyl]aniline
CID 112677945
1-(2-methoxyphenyl)-N-propylpropan-1-amine
CID 43279174
2-N-cyclopropyl-2-N-(2-methoxyethyl)benzene-1,2-diamine
CID 61453395
N-cyclopropyl-2-[1-(ethylamino)propyl]-N-prop-2-enylaniline
CID 112678265
N,N,N'-trimethyl-N'-[2-[1-(propylamino)propyl]phenyl]ethane-1,2-diamine
CID 115995247
N-butan-2-yl-N-methyl-2-[1-(propylamino)propyl]aniline
CID 112677858
N-[3-(2-methoxyethoxy)propyl]-1-(2-methoxyphenyl)propan-1-amine
CID 43770870
N-cyclopropyl-N-(cyclopropylmethyl)-2-[1-(methylamino)propyl]aniline
CID 112678176

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline (CID 115995005) is N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline is CCCNC(CC)c1ccccc1N(CCOC)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline?
The InChIKey is PFCYZTRUNKZZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-12-19-17(5-2)16-8-6-7-9-18(16)20(13-14-21-3)15-10-11-15/h6-9,15,17,19H,4-5,10-14H2,1-3H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline?
N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline has a molecular weight of 290.45 g/mol, XLogP of 3.75, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-2-[1-(propylamino)propyl]aniline is sourced from PubChem (CID 115995005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).