N-methyl-1-(2-propylmorpholin-4-yl)methanamine

C9H20N2O — CID 167045533

IUPACN-methyl-1-(2-propylmorpholin-4-yl)methanamine
SMILESCCCC1CN(CNC)CCO1
InChIInChI=1S/C9H20N2O/c1-3-4-9-7-11(8-10-2)5-6-12-9/h9-10H,3-8H2,1-2H3
InChIKeySIOBRZJNEMIHJE-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.66
Rot. Bonds4

About N-methyl-1-(2-propylmorpholin-4-yl)methanamine

N-methyl-1-(2-propylmorpholin-4-yl)methanamine (PubChem CID 167045533) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N-methyl-1-(2-propylmorpholin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-propylmorpholin-4-yl)methanamine
PubChem CID167045533
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN-methyl-1-(2-propylmorpholin-4-yl)methanamine
SMILESCCCC1CN(CNC)CCO1
InChIInChI=1S/C9H20N2O/c1-3-4-9-7-11(8-10-2)5-6-12-9/h9-10H,3-8H2,1-2H3
InChIKeySIOBRZJNEMIHJE-UHFFFAOYSA-N
XLogP0.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2-propylmorpholine
CID 127673597
2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
CID 94133449
2-(2-propylmorpholin-4-yl)acetonitrile
CID 130694336
2-[(2R)-4-ethylmorpholin-2-yl]-N-methylethanamine;molecular hydrogen
CID 169214323
4-propan-2-yl-2-propylmorpholine
CID 118118152
2-propylmorpholine-4-carbonyl chloride
CID 141381731
(2S)-2-butyl-4-decylmorpholine
CID 98152093
2-propylmorpholine-4-carbonitrile
CID 175059333
2,4-diethylmorpholine
CID 58988021
N-[2-(4-ethylmorpholin-2-yl)ethyl]-2-methylpropan-2-amine
CID 162424315
4-methyl-2-propyl-1,4-oxazepane
CID 165407409
1-(2-propylmorpholin-4-yl)ethanone
CID 89170982

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-propylmorpholin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(2-propylmorpholin-4-yl)methanamine (CID 167045533) is N-methyl-1-(2-propylmorpholin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-propylmorpholin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-propylmorpholin-4-yl)methanamine is CCCC1CN(CNC)CCO1.
What is the InChIKey of N-methyl-1-(2-propylmorpholin-4-yl)methanamine?
The InChIKey is SIOBRZJNEMIHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-3-4-9-7-11(8-10-2)5-6-12-9/h9-10H,3-8H2,1-2H3.
What are the key properties of N-methyl-1-(2-propylmorpholin-4-yl)methanamine?
N-methyl-1-(2-propylmorpholin-4-yl)methanamine has a molecular weight of 172.27 g/mol, XLogP of 0.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-propylmorpholin-4-yl)methanamine is sourced from PubChem (CID 167045533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).