N-methyl-N-[1-(methylamino)ethyl]ethanimidamide

C6H15N3 — CID 146392656

IUPACN-methyl-N-[1-(methylamino)ethyl]ethanimidamide
SMILES[H]/N=C(\C)N(C)C(C)NC
InChIInChI=1S/C6H15N3/c1-5(7)9(4)6(2)8-3/h6-8H,1-4H3/b7-5+
InChIKeyPHHIARGVCXWZRR-FNORWQNLSA-N
MW129.21 g/mol
LogP0.48
Rot. Bonds2

About N-methyl-N-[1-(methylamino)ethyl]ethanimidamide

N-methyl-N-[1-(methylamino)ethyl]ethanimidamide (PubChem CID 146392656) has the molecular formula C6H15N3 and a molecular weight of 129.21 g/mol. Its IUPAC name is N-methyl-N-[1-(methylamino)ethyl]ethanimidamide.

Molecular Properties

Compound NameN-methyl-N-[1-(methylamino)ethyl]ethanimidamide
PubChem CID146392656
Molecular FormulaC6H15N3
Molecular Weight129.21 g/mol
Exact Mass129.13
IUPAC NameN-methyl-N-[1-(methylamino)ethyl]ethanimidamide
SMILES[H]/N=C(\C)N(C)C(C)NC
InChIInChI=1S/C6H15N3/c1-5(7)9(4)6(2)8-3/h6-8H,1-4H3/b7-5+
InChIKeyPHHIARGVCXWZRR-FNORWQNLSA-N
XLogP0.48
TPSA39.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.21
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[ethanimidoyl(methyl)amino]propanoic acid
CID 59020920
(2S)-3-imino-N-methylbutan-2-amine
CID 147887389
N-methanimidoyl-N-[2-(methylamino)propyl]ethanimidamide
CID 139333475
N-hydrazinyl-N-methylethanimidamide
CID 143620098
methyl N-methyl-N-propan-2-ylcarbamimidate
CID 45087420
(E)-4-imino-N,N-dimethylpent-2-en-2-amine
CID 123583193
N-cyano-N-methylethanimidamide
CID 11629589
1-methyl-1-[(2R,6R)-6-(methylamino)heptan-2-yl]guanidine
CID 121450916
(Z)-5-methoxyhex-3-en-2-imine
CID 123705474
1-(1-hydroxyethyl)-1-methylguanidine
CID 21449246
(E)-2-methyl-3-(methylamino)prop-2-enimidoyl chloride
CID 167151920
N-(3,5-dimethylphenyl)-N-methylethanimidamide
CID 63173252

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(methylamino)ethyl]ethanimidamide?
The IUPAC name of N-methyl-N-[1-(methylamino)ethyl]ethanimidamide (CID 146392656) is N-methyl-N-[1-(methylamino)ethyl]ethanimidamide.
What is the SMILES notation for N-methyl-N-[1-(methylamino)ethyl]ethanimidamide?
The canonical SMILES for N-methyl-N-[1-(methylamino)ethyl]ethanimidamide is [H]/N=C(\C)N(C)C(C)NC.
What is the InChIKey of N-methyl-N-[1-(methylamino)ethyl]ethanimidamide?
The InChIKey is PHHIARGVCXWZRR-FNORWQNLSA-N. The full InChI is InChI=1S/C6H15N3/c1-5(7)9(4)6(2)8-3/h6-8H,1-4H3/b7-5+.
What are the key properties of N-methyl-N-[1-(methylamino)ethyl]ethanimidamide?
N-methyl-N-[1-(methylamino)ethyl]ethanimidamide has a molecular weight of 129.21 g/mol, XLogP of 0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(methylamino)ethyl]ethanimidamide is sourced from PubChem (CID 146392656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).