2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide

C10H17NO — CID 115627883

IUPAC2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide
SMILESC/C=C/CCNC(=O)C1CC1C
InChIInChI=1S/C10H17NO/c1-3-4-5-6-11-10(12)9-7-8(9)2/h3-4,8-9H,5-7H2,1-2H3,(H,11,12)/b4-3+
InChIKeyNDQLMPIKTRDAJK-ONEGZZNKSA-N
MW167.25 g/mol
LogP1.72
Rot. Bonds4

About 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide

2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide (PubChem CID 115627883) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide
PubChem CID115627883
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide
SMILESC/C=C/CCNC(=O)C1CC1C
InChIInChI=1S/C10H17NO/c1-3-4-5-6-11-10(12)9-7-8(9)2/h3-4,8-9H,5-7H2,1-2H3,(H,11,12)/b4-3+
InChIKeyNDQLMPIKTRDAJK-ONEGZZNKSA-N
XLogP1.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Methylarachidonoyl-(2'-fluoroethyl)amide
CID 5283437
N-3,7-Dimethyl-2,6-octadienyl cyclopropylcarboxamide, (2E)-
CID 11658617
Arachidonylcyclopropylamide
CID 5311007
N-propyl arachidonoyl amine
CID 5283394
(5Z,8Z,11Z,13S,14Z)-N-cyclopropyl-13-methylicosa-5,8,11,14-tetraenamide
CID 145971834
N-ethyl arachidonoyl amine
CID 5283391
N-(3-methyl-butyl)arachidonoylamide
CID 5283399
N-butyl arachidonoyl amine
CID 5283396
N-propyl alpha-methyl arachidonoyl amine
CID 5283416
N-isopropyl alpha-methylarachidonoyl amine
CID 5283418
(5Z,8Z,11Z,14Z)-N-(2-methylpropyl)icosa-5,8,11,14-tetraenamide
CID 10784715
N-amyl arachidohoyl amine
CID 5283398

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide?
The IUPAC name of 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide (CID 115627883) is 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide is C/C=C/CCNC(=O)C1CC1C.
What is the InChIKey of 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide?
The InChIKey is NDQLMPIKTRDAJK-ONEGZZNKSA-N. The full InChI is InChI=1S/C10H17NO/c1-3-4-5-6-11-10(12)9-7-8(9)2/h3-4,8-9H,5-7H2,1-2H3,(H,11,12)/b4-3+.
What are the key properties of 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide?
2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide has a molecular weight of 167.25 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 115627883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).