N-ethyl-N-prop-2-ynylcyclopropanecarboxamide

C9H13NO — CID 78970835

IUPACN-ethyl-N-prop-2-ynylcyclopropanecarboxamide
SMILESC#CCN(CC)C(=O)C1CC1
InChIInChI=1S/C9H13NO/c1-3-7-10(4-2)9(11)8-5-6-8/h1,8H,4-7H2,2H3
InChIKeyUUSIBVROTJXZNM-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.88
Rot. Bonds3

About N-ethyl-N-prop-2-ynylcyclopropanecarboxamide

N-ethyl-N-prop-2-ynylcyclopropanecarboxamide (PubChem CID 78970835) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is N-ethyl-N-prop-2-ynylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-ethyl-N-prop-2-ynylcyclopropanecarboxamide
PubChem CID78970835
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC NameN-ethyl-N-prop-2-ynylcyclopropanecarboxamide
SMILESC#CCN(CC)C(=O)C1CC1
InChIInChI=1S/C9H13NO/c1-3-7-10(4-2)9(11)8-5-6-8/h1,8H,4-7H2,2H3
InChIKeyUUSIBVROTJXZNM-UHFFFAOYSA-N
XLogP0.88
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-prop-2-ynylcyclopentanecarboxamide
CID 78970864
2-[ethyl(prop-2-ynyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103979079
N-propyl-N-prop-2-ynylcycloheptanecarboxamide
CID 78917353
N-ethyl-3-methyl-N-prop-2-ynylpyrrolidine-2-carboxamide
CID 102779892
N,4-diethyl-N-prop-2-ynylpiperidine-2-carboxamide
CID 114429394
3-cyclopentyl-N-ethyl-N-prop-2-ynylpropanamide
CID 78970322
2-[[cyclopropylmethyl(ethyl)carbamoyl]-prop-2-ynylamino]acetic acid
CID 79284715
N-ethyl-N-prop-2-ynyladamantane-1-carboxamide
CID 78971141
4-[cyclopropylmethyl(ethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63955071
N-(2-ethoxyethyl)-N-ethylcyclopropanecarboxamide
CID 63717858
N-propyl-N-prop-2-ynylcyclohex-3-ene-1-carboxamide
CID 78970491
N-ethyl-1-methyl-N-prop-2-ynylcyclopentane-1-carboxamide
CID 78971175

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-prop-2-ynylcyclopropanecarboxamide?
The IUPAC name of N-ethyl-N-prop-2-ynylcyclopropanecarboxamide (CID 78970835) is N-ethyl-N-prop-2-ynylcyclopropanecarboxamide.
What is the SMILES notation for N-ethyl-N-prop-2-ynylcyclopropanecarboxamide?
The canonical SMILES for N-ethyl-N-prop-2-ynylcyclopropanecarboxamide is C#CCN(CC)C(=O)C1CC1.
What is the InChIKey of N-ethyl-N-prop-2-ynylcyclopropanecarboxamide?
The InChIKey is UUSIBVROTJXZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-7-10(4-2)9(11)8-5-6-8/h1,8H,4-7H2,2H3.
What are the key properties of N-ethyl-N-prop-2-ynylcyclopropanecarboxamide?
N-ethyl-N-prop-2-ynylcyclopropanecarboxamide has a molecular weight of 151.21 g/mol, XLogP of 0.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-prop-2-ynylcyclopropanecarboxamide is sourced from PubChem (CID 78970835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).