N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine

C15H28N4O — CID 114530511

IUPACN-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine
SMILESCCCN1CCOC(C(CCc2nccn2C)NC)C1
InChIInChI=1S/C15H28N4O/c1-4-8-19-10-11-20-14(12-19)13(16-2)5-6-15-17-7-9-18(15)3/h7,9,13-14,16H,4-6,8,10-12H2,1-3H3
InChIKeyOJJUXGPOVPZWBP-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.05
Rot. Bonds7

About N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine

N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine (PubChem CID 114530511) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine
PubChem CID114530511
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC NameN-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine
SMILESCCCN1CCOC(C(CCc2nccn2C)NC)C1
InChIInChI=1S/C15H28N4O/c1-4-8-19-10-11-20-14(12-19)13(16-2)5-6-15-17-7-9-18(15)3/h7,9,13-14,16H,4-6,8,10-12H2,1-3H3
InChIKeyOJJUXGPOVPZWBP-UHFFFAOYSA-N
XLogP1.05
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79761546
1-(1,4-dioxan-2-yl)-N-ethyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105050021
1-(4-propylmorpholin-2-yl)butylhydrazine
CID 105247790
1-cyclobutyl-N-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530243
2-cyclopropyl-N-methyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79658247
2-(chloromethyl)-4-[2-(1-methylimidazol-2-yl)ethyl]morpholine
CID 114531807
N-ethyl-2-(1-methylimidazol-2-yl)-1-(4-methylmorpholin-2-yl)ethanamine
CID 79761166
3-(1-methylimidazol-2-yl)-1-(4-methylmorpholin-2-yl)propan-1-ol
CID 114529802
4-methoxy-N,4-dimethyl-1-(4-propylmorpholin-2-yl)pentan-1-amine
CID 103035909
2-(2,6-difluorophenyl)-N-methyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 114932414
N-methyl-1-(4-propylmorpholin-2-yl)-2-thiophen-2-ylethanamine
CID 79657546
N,2,2-trimethyl-1-(4-propylmorpholin-2-yl)propan-1-amine
CID 79658249

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine?
The IUPAC name of N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine (CID 114530511) is N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine.
What is the SMILES notation for N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine?
The canonical SMILES for N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine is CCCN1CCOC(C(CCc2nccn2C)NC)C1.
What is the InChIKey of N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine?
The InChIKey is OJJUXGPOVPZWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-4-8-19-10-11-20-14(12-19)13(16-2)5-6-15-17-7-9-18(15)3/h7,9,13-14,16H,4-6,8,10-12H2,1-3H3.
What are the key properties of N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine?
N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine has a molecular weight of 280.42 g/mol, XLogP of 1.05, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1-methylimidazol-2-yl)-1-(4-propylmorpholin-2-yl)propan-1-amine is sourced from PubChem (CID 114530511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).