N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine

C10H15N3 — CID 117010161

IUPACN-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine
SMILESCNCC1CN1Cc1ccccn1
InChIInChI=1S/C10H15N3/c1-11-6-10-8-13(10)7-9-4-2-3-5-12-9/h2-5,10-11H,6-8H2,1H3
InChIKeyIIWOKAGPZFMPSI-UHFFFAOYSA-N
MW177.25 g/mol
LogP0.49
Rot. Bonds4

About N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine

N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine (PubChem CID 117010161) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine
PubChem CID117010161
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine
SMILESCNCC1CN1Cc1ccccn1
InChIInChI=1S/C10H15N3/c1-11-6-10-8-13(10)7-9-4-2-3-5-12-9/h2-5,10-11H,6-8H2,1H3
InChIKeyIIWOKAGPZFMPSI-UHFFFAOYSA-N
XLogP0.49
TPSA27.93 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

5-methyl-4-(methylaminomethyl)-1-(pyridin-2-ylmethyl)pyrrolidin-2-one
CID 117022584
2-ethyl-5-methyl-1-(pyridin-2-ylmethyl)piperazine
CID 64844286
2-[(2-ethylazetidin-1-yl)methyl]pyridine
CID 130678024
5,5-dimethyl-4-(methylaminomethyl)-1-(pyridin-2-ylmethyl)pyrrolidin-2-one
CID 117023330
5-methyl-2-propyl-1-(pyridin-2-ylmethyl)piperazine
CID 64845678
5-tert-butyl-2-ethyl-1-(pyridin-2-ylmethyl)piperazine
CID 64842793
1-[2,2-dimethyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]-N-methylmethanamine
CID 117020753
2-methyl-N-[[1-(pyridin-2-ylmethyl)piperidin-2-yl]methyl]propan-2-amine
CID 62580597
5-(2-methylpropyl)-2-propyl-1-(pyridin-2-ylmethyl)piperazine
CID 64848923
2-methyl-N-[[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 62579835
1-(pyridin-2-ylmethyl)pyrrolidine-3,4-diol
CID 106672943
2-[[4,5-diphenyl-3-(pyridin-2-ylmethyl)imidazolidin-1-yl]methyl]pyridine
CID 175980206

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine (CID 117010161) is N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine is CNCC1CN1Cc1ccccn1.
What is the InChIKey of N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine?
The InChIKey is IIWOKAGPZFMPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-11-6-10-8-13(10)7-9-4-2-3-5-12-9/h2-5,10-11H,6-8H2,1H3.
What are the key properties of N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine?
N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine has a molecular weight of 177.25 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(pyridin-2-ylmethyl)aziridin-2-yl]methanamine is sourced from PubChem (CID 117010161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).