N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline

C16H24N2O — CID 43717227

IUPACN-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline
SMILESCC(Nc1ccccc1N1CCOCC1)C1(C)CC1
InChIInChI=1S/C16H24N2O/c1-13(16(2)7-8-16)17-14-5-3-4-6-15(14)18-9-11-19-12-10-18/h3-6,13,17H,7-12H2,1-2H3
InChIKeyBFPKTUVSUGLDRP-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.12
Rot. Bonds4

About N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline

N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline (PubChem CID 43717227) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline.

Molecular Properties

Compound NameN-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline
PubChem CID43717227
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline
SMILESCC(Nc1ccccc1N1CCOCC1)C1(C)CC1
InChIInChI=1S/C16H24N2O/c1-13(16(2)7-8-16)17-14-5-3-4-6-15(14)18-9-11-19-12-10-18/h3-6,13,17H,7-12H2,1-2H3
InChIKeyBFPKTUVSUGLDRP-UHFFFAOYSA-N
XLogP3.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-methylcyclopropyl)ethyl]-2-pyrrolidin-1-ylaniline
CID 43684228
N-(1-cyclopropylethyl)-2-morpholin-4-ylaniline
CID 43717242
2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline
CID 43717239
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
2-morpholin-4-yl-N-[1-(1,3-thiazol-4-yl)ethyl]aniline
CID 115925823
2-bromo-N-(2-morpholin-4-ylphenyl)propanamide
CID 107903089
2-amino-N-(2-morpholin-4-ylphenyl)propanethioamide
CID 88902286
4-N-(2-morpholin-4-ylphenyl)-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 112882201
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
1-amino-N-(2-morpholin-4-ylphenyl)cyclopropane-1-carboxamide
CID 65466155
N-[1-(1-methylcyclopropyl)ethyl]-4-(morpholin-4-ylmethyl)aniline
CID 43363279
(1R)-1-(2-morpholin-4-ylphenyl)ethanol
CID 78939110

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline?
The IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline (CID 43717227) is N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline.
What is the SMILES notation for N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline?
The canonical SMILES for N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline is CC(Nc1ccccc1N1CCOCC1)C1(C)CC1.
What is the InChIKey of N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline?
The InChIKey is BFPKTUVSUGLDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13(16(2)7-8-16)17-14-5-3-4-6-15(14)18-9-11-19-12-10-18/h3-6,13,17H,7-12H2,1-2H3.
What are the key properties of N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline?
N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline has a molecular weight of 260.38 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline is sourced from PubChem (CID 43717227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).