2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine

C14H18N4O — CID 114958077

IUPAC2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
SMILESCc1ccncc1Cn1cncc1C1CNCCO1
InChIInChI=1S/C14H18N4O/c1-11-2-3-15-6-12(11)9-18-10-17-7-13(18)14-8-16-4-5-19-14/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3
InChIKeyRXXPOOYNTAOMOI-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.30
Rot. Bonds3

About 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine

2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine (PubChem CID 114958077) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine.

Molecular Properties

Compound Name2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
PubChem CID114958077
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
SMILESCc1ccncc1Cn1cncc1C1CNCCO1
InChIInChI=1S/C14H18N4O/c1-11-2-3-15-6-12(11)9-18-10-17-7-13(18)14-8-16-4-5-19-14/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3
InChIKeyRXXPOOYNTAOMOI-UHFFFAOYSA-N
XLogP1.30
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-[(2-chlorophenyl)methyl]imidazol-4-yl]morpholine
CID 114716555
2-[3-(2-propan-2-yloxyethyl)imidazol-4-yl]morpholine
CID 114722434
2-[3-[(3-methoxyphenyl)methyl]imidazol-4-yl]morpholine
CID 114718323
2-[3-[(6-methoxy-3-pyridinyl)methyl]imidazol-4-yl]morpholine
CID 114720280
2-(3-but-3-ynylimidazol-4-yl)morpholine
CID 114720452
2-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]morpholine
CID 114718670
2-[3-(2,2-dimethylbutyl)imidazol-4-yl]morpholine
CID 103466943
2-(3-pyridin-3-ylimidazol-4-yl)morpholine
CID 114717439
2-[3-(2-thiophen-2-ylethyl)imidazol-4-yl]morpholine
CID 114717096
2-[3-(2,2-dicyclopropylethyl)imidazol-4-yl]morpholine
CID 114721021
N,N-diethyl-2-(5-morpholin-2-ylimidazol-1-yl)acetamide
CID 114721947
2-[3-[(1-ethylcyclobutyl)methyl]imidazol-4-yl]morpholine
CID 114109907

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine?
The IUPAC name of 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine (CID 114958077) is 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine.
What is the SMILES notation for 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine?
The canonical SMILES for 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine is Cc1ccncc1Cn1cncc1C1CNCCO1.
What is the InChIKey of 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine?
The InChIKey is RXXPOOYNTAOMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11-2-3-15-6-12(11)9-18-10-17-7-13(18)14-8-16-4-5-19-14/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3.
What are the key properties of 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine?
2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine has a molecular weight of 258.32 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine is sourced from PubChem (CID 114958077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).