N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine

C18H28N2O — CID 105347010

IUPACN-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine
SMILESCCC1CN(Cc2ccc(CCNC3CC3)cc2)CCO1
InChIInChI=1S/C18H28N2O/c1-2-18-14-20(11-12-21-18)13-16-5-3-15(4-6-16)9-10-19-17-7-8-17/h3-6,17-19H,2,7-14H2,1H3
InChIKeyGMMAOWPMTFKLIR-UHFFFAOYSA-N
MW288.43 g/mol
LogP2.59
Rot. Bonds7

About N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine

N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine (PubChem CID 105347010) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine
PubChem CID105347010
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC NameN-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine
SMILESCCC1CN(Cc2ccc(CCNC3CC3)cc2)CCO1
InChIInChI=1S/C18H28N2O/c1-2-18-14-20(11-12-21-18)13-16-5-3-15(4-6-16)9-10-19-17-7-8-17/h3-6,17-19H,2,7-14H2,1H3
InChIKeyGMMAOWPMTFKLIR-UHFFFAOYSA-N
XLogP2.59
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[(2-ethylmorpholin-4-yl)methyl]thiophen-2-yl]methyl]cyclopropanamine
CID 107555922
N-[2-[4-[(3-methoxypiperidin-1-yl)methyl]phenyl]ethyl]cyclopropanamine
CID 102968242
N-[2-[2-[(2-methylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine
CID 115463473
2-ethyl-4-(2-phenylethyl)morpholine
CID 59586000
2-(4-benzylmorpholin-2-yl)-N-[2-(cycloheptylamino)ethyl]acetamide
CID 119620021
2-amino-4-[(2-ethylmorpholin-4-yl)methyl]phenol
CID 43562236
N-[[4-[(2-ethylmorpholin-4-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391826
2-bromo-4-[(2-ethylmorpholin-4-yl)methyl]phenol
CID 82976620
N-[2-(4-ethylphenyl)ethyl]cyclopropanamine
CID 62550255
N-[2-(3-chloro-4-methylphenyl)ethyl]cyclopropanamine
CID 106818906
N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine
CID 62256460
N-[[4-[(2-methyl-1,4-oxazepan-4-yl)methyl]phenyl]methyl]cyclopropanamine
CID 62974101

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine?
The IUPAC name of N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine (CID 105347010) is N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine?
The canonical SMILES for N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine is CCC1CN(Cc2ccc(CCNC3CC3)cc2)CCO1.
What is the InChIKey of N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine?
The InChIKey is GMMAOWPMTFKLIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-18-14-20(11-12-21-18)13-16-5-3-15(4-6-16)9-10-19-17-7-8-17/h3-6,17-19H,2,7-14H2,1H3.
What are the key properties of N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine?
N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine has a molecular weight of 288.43 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine is sourced from PubChem (CID 105347010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).