N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine

C14H28N2O — CID 62256460

IUPACN-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine
SMILESCCC1CN(CC(C)(C)CNC2CC2)CCO1
InChIInChI=1S/C14H28N2O/c1-4-13-9-16(7-8-17-13)11-14(2,3)10-15-12-5-6-12/h12-13,15H,4-11H2,1-3H3
InChIKeyBBHRQQDTFORQQO-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds6

About N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine

N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine (PubChem CID 62256460) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine
PubChem CID62256460
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine
SMILESCCC1CN(CC(C)(C)CNC2CC2)CCO1
InChIInChI=1S/C14H28N2O/c1-4-13-9-16(7-8-17-13)11-14(2,3)10-15-12-5-6-12/h12-13,15H,4-11H2,1-3H3
InChIKeyBBHRQQDTFORQQO-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropan-1-amine
CID 62258556
1-(2-ethylmorpholin-4-yl)-2-methylpropan-2-ol
CID 60885104
N-[2,2-dimethyl-3-(3-methylpiperidin-1-yl)propyl]cyclopropanamine
CID 62263551
N-(2,2-dimethyl-3-piperidin-1-ylpropyl)cyclopropanamine
CID 62262081
2-[(2-ethylmorpholin-4-yl)methyl]-2-methyl-N-propan-2-ylbutan-1-amine
CID 62258034
2,4-diethylmorpholine
CID 58988021
N-[[4-[(2-ethylmorpholin-4-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391826
[4-[2,2-dimethyl-3-(propan-2-ylamino)propyl]morpholin-2-yl]methanol
CID 81213628
N-[2-[4-[(2-ethylmorpholin-4-yl)methyl]phenyl]ethyl]cyclopropanamine
CID 105347010
N-[[5-[(2-ethylmorpholin-4-yl)methyl]thiophen-2-yl]methyl]cyclopropanamine
CID 107555922
2-(cyclopropylamino)-3-(2-ethyl-1,4-oxazepan-4-yl)-2-methylpropanoic acid
CID 114218703
1-(2-ethyl-1,4-oxazepan-4-yl)-2-methylpropan-2-amine;hydrochloride
CID 120849628

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine?
The IUPAC name of N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine (CID 62256460) is N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine.
What is the SMILES notation for N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine?
The canonical SMILES for N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine is CCC1CN(CC(C)(C)CNC2CC2)CCO1.
What is the InChIKey of N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine?
The InChIKey is BBHRQQDTFORQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-13-9-16(7-8-17-13)11-14(2,3)10-15-12-5-6-12/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine?
N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropyl]cyclopropanamine is sourced from PubChem (CID 62256460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).