N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine

C12H19N3O — CID 80502656

IUPACN-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine
SMILESCNCC1CN(Cc2cccnc2)CCO1
InChIInChI=1S/C12H19N3O/c1-13-8-12-10-15(5-6-16-12)9-11-3-2-4-14-7-11/h2-4,7,12-13H,5-6,8-10H2,1H3
InChIKeyURDXLRPQNAZUMY-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.50
Rot. Bonds4

About N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine

N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine (PubChem CID 80502656) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine
PubChem CID80502656
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine
SMILESCNCC1CN(Cc2cccnc2)CCO1
InChIInChI=1S/C12H19N3O/c1-13-8-12-10-15(5-6-16-12)9-11-3-2-4-14-7-11/h2-4,7,12-13H,5-6,8-10H2,1H3
InChIKeyURDXLRPQNAZUMY-UHFFFAOYSA-N
XLogP0.50
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(pyridin-3-ylmethyl)morpholine
CID 95274004
1-[(2S)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]-N-methylmethanamine;ethane
CID 143608551
N,N-dimethyl-4-[2-[(2S)-4-(pyridin-3-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 125001767
4-(2-phenylethyl)-2-(pyridin-3-ylmethyl)morpholine
CID 102604196
(2S)-4-(2-phenylethyl)-2-(pyridin-3-ylmethyl)morpholine
CID 124945226
[4-(pyridin-3-ylmethyl)morpholin-2-yl]-pyrrolidin-1-ylmethanone
CID 155800017
16-(pyridin-3-ylmethyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 11523230
1-(4-benzylmorpholin-2-yl)-N-iodomethanamine
CID 163437962
2-(chloromethyl)-4-(pyridin-4-ylmethyl)morpholine
CID 81210247
(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyridin-3-ylmethyl)morpholine
CID 92575825
[4-(pyridin-4-ylmethyl)morpholin-2-yl]methanol
CID 79841050
N-[(4-benzylmorpholin-2-yl)methyl]pyridine-4-carboxamide
CID 43019906

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine (CID 80502656) is N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine is CNCC1CN(Cc2cccnc2)CCO1.
What is the InChIKey of N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine?
The InChIKey is URDXLRPQNAZUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-13-8-12-10-15(5-6-16-12)9-11-3-2-4-14-7-11/h2-4,7,12-13H,5-6,8-10H2,1H3.
What are the key properties of N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine?
N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine has a molecular weight of 221.30 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(pyridin-3-ylmethyl)morpholin-2-yl]methanamine is sourced from PubChem (CID 80502656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).