N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine

C18H28N2O — CID 79971008

IUPACN-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
SMILESCC(C)NCC1OCCN(C)C1c1ccc(C2CC2)cc1
InChIInChI=1S/C18H28N2O/c1-13(2)19-12-17-18(20(3)10-11-21-17)16-8-6-15(7-9-16)14-4-5-14/h6-9,13-14,17-19H,4-5,10-12H2,1-3H3
InChIKeyQWIZIVWDMJRKGD-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.93
Rot. Bonds5

About N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine

N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine (PubChem CID 79971008) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
PubChem CID79971008
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
SMILESCC(C)NCC1OCCN(C)C1c1ccc(C2CC2)cc1
InChIInChI=1S/C18H28N2O/c1-13(2)19-12-17-18(20(3)10-11-21-17)16-8-6-15(7-9-16)14-4-5-14/h6-9,13-14,17-19H,4-5,10-12H2,1-3H3
InChIKeyQWIZIVWDMJRKGD-UHFFFAOYSA-N
XLogP2.93
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-(4-cyclopropylphenyl)-1-methylpyrrolidin-3-yl]methyl]propan-2-amine
CID 79977325
N-[[3-(3-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]cyclopropanamine
CID 79971167
N-[[3-(2-ethylpyrazol-3-yl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 114557715
N-[[4-methyl-3-(3-methylimidazol-4-yl)morpholin-2-yl]methyl]propan-2-amine
CID 66118550
N-[[3-(2-bromo-5-chlorophenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 66159173
[3-(4-cyclopropylphenyl)-4-propan-2-ylmorpholin-2-yl]methanamine
CID 79978573
N-[(4-cyclopropylphenyl)methyl]propan-2-amine
CID 62491335
N-[[3-(3-chloro-4-fluorophenyl)-4-methylmorpholin-2-yl]methyl]cyclopropanamine
CID 81160749
[(2R,3R)-4-methyl-3-phenylmorpholin-2-yl]methanamine
CID 124832574
N-[[2-[4-(difluoromethyl)phenyl]-1-methylpyrrolidin-3-yl]methyl]propan-2-amine
CID 115525468
N-[[3-(1-ethylpyrazol-4-yl)-4-methylmorpholin-2-yl]methyl]cyclopropanamine
CID 103570741
N-[[3-(3-chloro-4-methoxyphenyl)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 65021885

Frequently Asked Questions

What is the IUPAC name of N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine (CID 79971008) is N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine is CC(C)NCC1OCCN(C)C1c1ccc(C2CC2)cc1.
What is the InChIKey of N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine?
The InChIKey is QWIZIVWDMJRKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-13(2)19-12-17-18(20(3)10-11-21-17)16-8-6-15(7-9-16)14-4-5-14/h6-9,13-14,17-19H,4-5,10-12H2,1-3H3.
What are the key properties of N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine?
N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine has a molecular weight of 288.44 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 79971008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).