N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine

C13H28N2O — CID 79658249

IUPACN,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine
SMILESCCCN1CCOC(C(NC)C(C)(C)C)C1
InChIInChI=1S/C13H28N2O/c1-6-7-15-8-9-16-11(10-15)12(14-5)13(2,3)4/h11-12,14H,6-10H2,1-5H3
InChIKeySEIVKBZVUULNKP-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds4

About N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine

N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine (PubChem CID 79658249) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine
PubChem CID79658249
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine
SMILESCCCN1CCOC(C(NC)C(C)(C)C)C1
InChIInChI=1S/C13H28N2O/c1-6-7-15-8-9-16-11(10-15)12(14-5)13(2,3)4/h11-12,14H,6-10H2,1-5H3
InChIKeySEIVKBZVUULNKP-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-propan-2-yl-4-propylmorpholine
CID 58468712
4-methoxy-N,4-dimethyl-1-(4-propylmorpholin-2-yl)pentan-1-amine
CID 103035909
N-ethyl-1-(4-ethylmorpholin-2-yl)-2,2-dimethylpropan-1-amine
CID 79668725
2-cyclopropyl-N-methyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79658247
1-(4-propylmorpholin-2-yl)ethanamine
CID 79658084
1-(4-propylmorpholin-2-yl)butylhydrazine
CID 105247790
N-methyl-1-(4-methylphenyl)-1-(4-propylmorpholin-2-yl)methanamine
CID 79657622
N-methyl-1-(4-propylmorpholin-2-yl)-2-thiophen-2-ylethanamine
CID 79657546
2-(2,6-difluorophenyl)-N-methyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 114932414
1-(4-propylmorpholin-2-yl)pentan-1-ol
CID 79668705
N-[cyclopropyl-(4-propylmorpholin-2-yl)methyl]ethanamine
CID 79657331
2-(5-chlorothiophen-2-yl)-N-methyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79657785

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine?
The IUPAC name of N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine (CID 79658249) is N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine?
The canonical SMILES for N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine is CCCN1CCOC(C(NC)C(C)(C)C)C1.
What is the InChIKey of N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine?
The InChIKey is SEIVKBZVUULNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-6-7-15-8-9-16-11(10-15)12(14-5)13(2,3)4/h11-12,14H,6-10H2,1-5H3.
What are the key properties of N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine?
N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine has a molecular weight of 228.38 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine is sourced from PubChem (CID 79658249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).