N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide

C12H17N3 — CID 63175508

IUPACN-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(C)CCc1ccccn1
InChIInChI=1S/C12H17N3/c1-15(12(13)10-5-6-10)9-7-11-4-2-3-8-14-11/h2-4,8,10,13H,5-7,9H2,1H3/b13-12+
InChIKeyZPLXRJKZPFOGNR-OUKQBFOZSA-N
MW203.29 g/mol
LogP1.94
Rot. Bonds4

About N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide

N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide (PubChem CID 63175508) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide
PubChem CID63175508
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC NameN-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(C)CCc1ccccn1
InChIInChI=1S/C12H17N3/c1-15(12(13)10-5-6-10)9-7-11-4-2-3-8-14-11/h2-4,8,10,13H,5-7,9H2,1H3/b13-12+
InChIKeyZPLXRJKZPFOGNR-OUKQBFOZSA-N
XLogP1.94
TPSA39.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172839
ethane;N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172838
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
methyl(2-pyridin-2-ylethyl)carbamodithioic acid
CID 88510653
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
2-bromo-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 116816951
1-(aminomethyl)-4-[methyl(2-pyridin-2-ylethyl)amino]cyclohexan-1-ol
CID 117039421
(2R)-N-methyl-N-(2-pyridin-2-ylethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 26458421
3-methyl-1-[methyl(2-pyridin-2-ylethyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 102781714
2-chloro-6-[methyl(2-pyridin-2-ylethyl)amino]benzenecarboximidamide
CID 62502784
1-[methyl(2-pyridin-2-ylethyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61195359
N-methyl-2-pyridin-2-yl-N-trimethylsilylethanamine
CID 91709658

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide?
The IUPAC name of N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide (CID 63175508) is N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide.
What is the SMILES notation for N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide?
The canonical SMILES for N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide is [H]/N=C(\C1CC1)N(C)CCc1ccccn1.
What is the InChIKey of N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide?
The InChIKey is ZPLXRJKZPFOGNR-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H17N3/c1-15(12(13)10-5-6-10)9-7-11-4-2-3-8-14-11/h2-4,8,10,13H,5-7,9H2,1H3/b13-12+.
What are the key properties of N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide?
N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide has a molecular weight of 203.29 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyridin-2-ylethyl)cyclopropanecarboximidamide is sourced from PubChem (CID 63175508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).