N-methyl-N'-prop-1-enyl-N-propylmethanimidamide

C8H16N2 — CID 123631518

IUPACN-methyl-N'-prop-1-enyl-N-propylmethanimidamide
SMILESCC=C/N=C/N(C)CCC
InChIInChI=1S/C8H16N2/c1-4-6-9-8-10(3)7-5-2/h4,6,8H,5,7H2,1-3H3/b6-4?,9-8+
InChIKeyLUJIAKOOJFANGO-CHPNIIKKSA-N
MW140.23 g/mol
LogP1.89
Rot. Bonds4

About N-methyl-N'-prop-1-enyl-N-propylmethanimidamide

N-methyl-N'-prop-1-enyl-N-propylmethanimidamide (PubChem CID 123631518) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-methyl-N'-prop-1-enyl-N-propylmethanimidamide.

Molecular Properties

Compound NameN-methyl-N'-prop-1-enyl-N-propylmethanimidamide
PubChem CID123631518
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-methyl-N'-prop-1-enyl-N-propylmethanimidamide
SMILESCC=C/N=C/N(C)CCC
InChIInChI=1S/C8H16N2/c1-4-6-9-8-10(3)7-5-2/h4,6,8H,5,7H2,1-3H3/b6-4?,9-8+
InChIKeyLUJIAKOOJFANGO-CHPNIIKKSA-N
XLogP1.89
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-N'-prop-1-enyl-N-propylmethanimidamide 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

3-Methyl-3,4-dihydropyrimidine
CID 19788969
N,N-dimethyl-N'-[(E)-prop-1-enyl]-methanimidamide
CID 24976956
1-Butyl-1-methylimidazol-1-ium
CID 9855929
1,1-Dipropylimidazol-1-ium bromide
CID 17814185
1,1-Dipropylimidazol-1-ium
CID 17814186
1,1-Dibutylimidazol-1-ium
CID 17814187
1-Ethyl-1-propylimidazol-1-ium
CID 18377226
1-Butyl-1-propylimidazol-1-ium
CID 18377230
1-Butyl-1-ethylimidazol-1-ium
CID 18377238
1-Butyl-1-ethenylimidazol-1-ium
CID 18920687
1-methyl-4H-pyrimidine
CID 19759614
1-Methyl-1-prop-2-enylimidazol-1-ium
CID 23042760

Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-prop-1-enyl-N-propylmethanimidamide?
The IUPAC name of N-methyl-N'-prop-1-enyl-N-propylmethanimidamide (CID 123631518) is N-methyl-N'-prop-1-enyl-N-propylmethanimidamide.
What is the SMILES notation for N-methyl-N'-prop-1-enyl-N-propylmethanimidamide?
The canonical SMILES for N-methyl-N'-prop-1-enyl-N-propylmethanimidamide is CC=C/N=C/N(C)CCC.
What is the InChIKey of N-methyl-N'-prop-1-enyl-N-propylmethanimidamide?
The InChIKey is LUJIAKOOJFANGO-CHPNIIKKSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-6-9-8-10(3)7-5-2/h4,6,8H,5,7H2,1-3H3/b6-4?,9-8+.
What are the key properties of N-methyl-N'-prop-1-enyl-N-propylmethanimidamide?
N-methyl-N'-prop-1-enyl-N-propylmethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-prop-1-enyl-N-propylmethanimidamide is sourced from PubChem (CID 123631518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).