N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine

C13H17N5O — CID 62761397

IUPACN-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine
SMILESc1ncc(CNc2ccc(N3CCOCC3)nc2)[nH]1
InChIInChI=1S/C13H17N5O/c1-2-13(18-3-5-19-6-4-18)16-8-11(1)15-9-12-7-14-10-17-12/h1-2,7-8,10,15H,3-6,9H2,(H,14,17)
InChIKeyLDVDEURYILPBNW-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.25
Rot. Bonds4

About N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine

N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine (PubChem CID 62761397) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine.

Molecular Properties

Compound NameN-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine
PubChem CID62761397
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine
SMILESc1ncc(CNc2ccc(N3CCOCC3)nc2)[nH]1
InChIInChI=1S/C13H17N5O/c1-2-13(18-3-5-19-6-4-18)16-8-11(1)15-9-12-7-14-10-17-12/h1-2,7-8,10,15H,3-6,9H2,(H,14,17)
InChIKeyLDVDEURYILPBNW-UHFFFAOYSA-N
XLogP1.25
TPSA66.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724722
N-benzyl-6-morpholin-4-ylpyridin-3-amine
CID 43724757
6-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 43724741
6-imidazol-1-yl-N-(1H-imidazol-5-ylmethyl)pyridin-3-amine
CID 62762109
N-(furan-3-ylmethyl)-6-morpholin-4-ylpyridin-3-amine
CID 63204595
N-[(5-methylthiophen-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724710
N-[(5-bromofuran-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724750
N-[(3-ethylimidazol-4-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 66134418
N-[(4,5-dibromofuran-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 62084831
N-butyl-6-morpholin-4-ylpyridin-3-amine
CID 43724794
N-[(3-methylthiophen-2-yl)methyl]-6-morpholin-4-ylpyridin-3-amine
CID 43724746
N'-tert-butyl-N-(6-morpholin-4-yl-3-pyridinyl)ethane-1,2-diamine
CID 107445126

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine?
The IUPAC name of N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine (CID 62761397) is N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine.
What is the SMILES notation for N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine?
The canonical SMILES for N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine is c1ncc(CNc2ccc(N3CCOCC3)nc2)[nH]1.
What is the InChIKey of N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine?
The InChIKey is LDVDEURYILPBNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-2-13(18-3-5-19-6-4-18)16-8-11(1)15-9-12-7-14-10-17-12/h1-2,7-8,10,15H,3-6,9H2,(H,14,17).
What are the key properties of N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine?
N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine has a molecular weight of 259.31 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-5-ylmethyl)-6-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 62761397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).