1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine

C14H26N4O — CID 66129529

IUPAC1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
SMILESCCCn1cncc1CNC(C)CN1CCOCC1
InChIInChI=1S/C14H26N4O/c1-3-4-18-12-15-9-14(18)10-16-13(2)11-17-5-7-19-8-6-17/h9,12-13,16H,3-8,10-11H2,1-2H3
InChIKeyNEEFYEZZTDQJQK-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.10
Rot. Bonds7

About 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine

1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine (PubChem CID 66129529) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
PubChem CID66129529
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
SMILESCCCn1cncc1CNC(C)CN1CCOCC1
InChIInChI=1S/C14H26N4O/c1-3-4-18-12-15-9-14(18)10-16-13(2)11-17-5-7-19-8-6-17/h9,12-13,16H,3-8,10-11H2,1-2H3
InChIKeyNEEFYEZZTDQJQK-UHFFFAOYSA-N
XLogP1.10
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-morpholin-4-yl-N-[(1-propylimidazol-2-yl)methyl]propan-2-amine
CID 62956125
1-imidazol-1-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66131355
1-cyclopropyl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66130194
1-phenyl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66130984
N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 115761765
N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine
CID 66152169
N-[(1-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 78921223
1-(4-fluorophenyl)-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66130587
1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
CID 62699740
N-[(3-ethylimidazol-4-yl)methyl]morpholin-4-amine
CID 83008990
4-methyl-3-[(3-propylimidazol-4-yl)methylamino]pentan-1-ol
CID 106348786
(1S)-N-[(3-propylimidazol-4-yl)methyl]-1-pyridin-4-ylethanamine
CID 81405734

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine?
The IUPAC name of 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine (CID 66129529) is 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine?
The canonical SMILES for 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine is CCCn1cncc1CNC(C)CN1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine?
The InChIKey is NEEFYEZZTDQJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-3-4-18-12-15-9-14(18)10-16-13(2)11-17-5-7-19-8-6-17/h9,12-13,16H,3-8,10-11H2,1-2H3.
What are the key properties of 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine?
1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine has a molecular weight of 266.39 g/mol, XLogP of 1.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine is sourced from PubChem (CID 66129529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).