N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide

C11H14N2O — CID 130527162

IUPACN-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide
SMILESCc1ccnc(C)c1NC(=O)C1CC1
InChIInChI=1S/C11H14N2O/c1-7-5-6-12-8(2)10(7)13-11(14)9-3-4-9/h5-6,9H,3-4H2,1-2H3,(H,13,14)
InChIKeyKDZIRZYAQGCBPI-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.05
Rot. Bonds2

About N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide

N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide (PubChem CID 130527162) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide
PubChem CID130527162
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide
SMILESCc1ccnc(C)c1NC(=O)C1CC1
InChIInChI=1S/C11H14N2O/c1-7-5-6-12-8(2)10(7)13-11(14)9-3-4-9/h5-6,9H,3-4H2,1-2H3,(H,13,14)
InChIKeyKDZIRZYAQGCBPI-UHFFFAOYSA-N
XLogP2.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide?
The IUPAC name of N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide (CID 130527162) is N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide?
The canonical SMILES for N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide is Cc1ccnc(C)c1NC(=O)C1CC1.
What is the InChIKey of N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide?
The InChIKey is KDZIRZYAQGCBPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-7-5-6-12-8(2)10(7)13-11(14)9-3-4-9/h5-6,9H,3-4H2,1-2H3,(H,13,14).
What are the key properties of N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide?
N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide has a molecular weight of 190.25 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide is sourced from PubChem (CID 130527162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).