N-(3-formamidopropyl)-N-methylprop-2-enamide

C8H14N2O2 — CID 141060601

IUPACN-(3-formamidopropyl)-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)CCCNC=O
InChIInChI=1S/C8H14N2O2/c1-3-8(12)10(2)6-4-5-9-7-11/h3,7H,1,4-6H2,2H3,(H,9,11)
InChIKeyNVEWTUSUNNNJFU-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.23
Rot. Bonds6

About N-(3-formamidopropyl)-N-methylprop-2-enamide

N-(3-formamidopropyl)-N-methylprop-2-enamide (PubChem CID 141060601) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is N-(3-formamidopropyl)-N-methylprop-2-enamide.

Molecular Properties

Compound NameN-(3-formamidopropyl)-N-methylprop-2-enamide
PubChem CID141060601
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC NameN-(3-formamidopropyl)-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)CCCNC=O
InChIInChI=1S/C8H14N2O2/c1-3-8(12)10(2)6-4-5-9-7-11/h3,7H,1,4-6H2,2H3,(H,9,11)
InChIKeyNVEWTUSUNNNJFU-UHFFFAOYSA-N
XLogP-0.23
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-(3-formamidopropyl)-N-methylprop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[3-[methyl(prop-2-enoyl)amino]propyl]prop-2-enamide
CID 59017028
N-[3-(dimethylamino)propyl]-N-methylprop-2-enamide;hydrazine
CID 162091587
4-[methyl(prop-2-enoyl)amino]butanoic acid
CID 43151837
CID 58422062
CID 58422062
(E)-N-(2-formamidoethyl)-N-methylbut-2-enamide
CID 176580093
N-[6-[hexa-1,5-dien-2-yl(methyl)amino]hexyl]formamide
CID 155696813
triethyl-[3-[methyl(prop-2-enoyl)amino]propyl]azanium
CID 141091344
3-[methyl(prop-2-enoyl)amino]propyl 2-methylpropanoate
CID 134486156
N,2-dimethyl-N-[2-[methyl(prop-2-enoyl)amino]ethyl]prop-2-enamide
CID 23525820
3-[methyl(prop-2-enoyl)amino]propyl butanoate
CID 134486208
N-methyl-N-(4-phenylbutyl)prop-2-enamide
CID 60949708
N-methyl-N-(sulfanylmethyl)prop-2-enamide
CID 170148935

Frequently Asked Questions

What is the IUPAC name of N-(3-formamidopropyl)-N-methylprop-2-enamide?
The IUPAC name of N-(3-formamidopropyl)-N-methylprop-2-enamide (CID 141060601) is N-(3-formamidopropyl)-N-methylprop-2-enamide.
What is the SMILES notation for N-(3-formamidopropyl)-N-methylprop-2-enamide?
The canonical SMILES for N-(3-formamidopropyl)-N-methylprop-2-enamide is C=CC(=O)N(C)CCCNC=O.
What is the InChIKey of N-(3-formamidopropyl)-N-methylprop-2-enamide?
The InChIKey is NVEWTUSUNNNJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-3-8(12)10(2)6-4-5-9-7-11/h3,7H,1,4-6H2,2H3,(H,9,11).
What are the key properties of N-(3-formamidopropyl)-N-methylprop-2-enamide?
N-(3-formamidopropyl)-N-methylprop-2-enamide has a molecular weight of 170.21 g/mol, XLogP of -0.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-formamidopropyl)-N-methylprop-2-enamide is sourced from PubChem (CID 141060601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).