[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine

C11H20N4O — CID 66147556

IUPAC[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine
SMILESNCc1cncn1CCCN1CCOCC1
InChIInChI=1S/C11H20N4O/c12-8-11-9-13-10-15(11)3-1-2-14-4-6-16-7-5-14/h9-10H,1-8,12H2
InChIKeyLVAUSPRLARRYLN-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.06
Rot. Bonds5

About [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine

[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine (PubChem CID 66147556) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine.

Molecular Properties

Compound Name[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine
PubChem CID66147556
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine
SMILESNCc1cncn1CCCN1CCOCC1
InChIInChI=1S/C11H20N4O/c12-8-11-9-13-10-15(11)3-1-2-14-4-6-16-7-5-14/h9-10H,1-8,12H2
InChIKeyLVAUSPRLARRYLN-UHFFFAOYSA-N
XLogP0.06
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]ethanamine
CID 114717654
(1R)-1-[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]propan-1-amine
CID 104942116
[3-(2-fluoroethyl)imidazol-4-yl]methanamine;hydrochloride
CID 131637916
4-[5-[3-(3-piperidin-1-ylpropyl)imidazol-4-yl]pyrimidin-2-yl]morpholine
CID 46980393
4-[5-(aminomethyl)imidazol-1-yl]-N,N-dimethylbutan-1-amine
CID 66150121
N-[(3-methylimidazol-4-yl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 62997683
[3-(2-methoxyethyl)imidazol-4-yl]methanamine;dihydrochloride
CID 75530754
1-(3-morpholin-4-ylpropyl)pyrazol-3-amine
CID 63310505
1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66129529
[3-[3-(1H-imidazol-2-yl)propyl]imidazol-4-yl]methanamine
CID 114707746
[3-(oxan-3-ylmethyl)imidazol-4-yl]methanamine
CID 66149687
7-morpholin-4-ylheptan-1-amine
CID 28596900

Frequently Asked Questions

What is the IUPAC name of [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine?
The IUPAC name of [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine (CID 66147556) is [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine.
What is the SMILES notation for [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine?
The canonical SMILES for [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine is NCc1cncn1CCCN1CCOCC1.
What is the InChIKey of [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine?
The InChIKey is LVAUSPRLARRYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c12-8-11-9-13-10-15(11)3-1-2-14-4-6-16-7-5-14/h9-10H,1-8,12H2.
What are the key properties of [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine?
[3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine has a molecular weight of 224.31 g/mol, XLogP of 0.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-morpholin-4-ylpropyl)imidazol-4-yl]methanamine is sourced from PubChem (CID 66147556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).