N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine

C14H26N4O — CID 91776525

IUPACN-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
SMILESCC(C)n1cncc1CN(C)CCN1CCOCC1
InChIInChI=1S/C14H26N4O/c1-13(2)18-12-15-10-14(18)11-16(3)4-5-17-6-8-19-9-7-17/h10,12-13H,4-9,11H2,1-3H3
InChIKeyOUCGQRFQWJKDSQ-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.23
Rot. Bonds6

About N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine

N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine (PubChem CID 91776525) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
PubChem CID91776525
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine
SMILESCC(C)n1cncc1CN(C)CCN1CCOCC1
InChIInChI=1S/C14H26N4O/c1-13(2)18-12-15-10-14(18)11-16(3)4-5-17-6-8-19-9-7-17/h10,12-13H,4-9,11H2,1-3H3
InChIKeyOUCGQRFQWJKDSQ-UHFFFAOYSA-N
XLogP1.23
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The IUPAC name of N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine (CID 91776525) is N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine.
What is the SMILES notation for N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The canonical SMILES for N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine is CC(C)n1cncc1CN(C)CCN1CCOCC1.
What is the InChIKey of N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
The InChIKey is OUCGQRFQWJKDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-13(2)18-12-15-10-14(18)11-16(3)4-5-17-6-8-19-9-7-17/h10,12-13H,4-9,11H2,1-3H3.
What are the key properties of N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine?
N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine has a molecular weight of 266.39 g/mol, XLogP of 1.23, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-4-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]ethanamine is sourced from PubChem (CID 91776525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).