N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine

C8H18N2 — CID 103069294

IUPACN'-methyl-2-methylidene-N'-propylpropane-1,3-diamine
SMILESC=C(CN)CN(C)CCC
InChIInChI=1S/C8H18N2/c1-4-5-10(3)7-8(2)6-9/h2,4-7,9H2,1,3H3
InChIKeyPRMAYKQHEMAILV-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.84
Rot. Bonds5

About N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine

N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine (PubChem CID 103069294) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-methyl-2-methylidene-N'-propylpropane-1,3-diamine
PubChem CID103069294
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN'-methyl-2-methylidene-N'-propylpropane-1,3-diamine
SMILESC=C(CN)CN(C)CCC
InChIInChI=1S/C8H18N2/c1-4-5-10(3)7-8(2)6-9/h2,4-7,9H2,1,3H3
InChIKeyPRMAYKQHEMAILV-UHFFFAOYSA-N
XLogP0.84
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(aminomethyl)prop-2-enyl-methylamino]propan-1-ol
CID 103071256
2-[[butyl(methyl)amino]methyl]prop-2-ene-1-thiol
CID 103073241
N-butyl-N,4,4-trimethyl-2-methylidenepentan-1-amine
CID 129311029
ethane;N'-methyl-N'-propylethane-1,2-diamine
CID 164863386
ethane;2-[methyl(propyl)amino]acetic acid
CID 153373363
2-[methyl(propyl)amino]acetic acid;hydrochloride
CID 50988218
N,N'-dimethyl-N'-[2-[methyl(propyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 162082787
2-[methyl(propyl)amino]acetic acid;pentan-1-amine
CID 175371891
2-[methyl-[2-(propylaminomethyl)prop-2-enyl]amino]ethanol
CID 103069520
N-[[4-(aminomethyl)phenyl]methyl]-N-methylpropan-1-amine
CID 43270951
ethene;N-ethyl-N-methylpropan-1-amine
CID 153352940
N-[2-(dimethylamino)ethyl]-N'-ethyl-N-methyl-2-methylidenepropane-1,3-diamine
CID 103070658

Frequently Asked Questions

What is the IUPAC name of N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The IUPAC name of N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine (CID 103069294) is N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine.
What is the SMILES notation for N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The canonical SMILES for N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine is C=C(CN)CN(C)CCC.
What is the InChIKey of N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The InChIKey is PRMAYKQHEMAILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-4-5-10(3)7-8(2)6-9/h2,4-7,9H2,1,3H3.
What are the key properties of N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine has a molecular weight of 142.25 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-2-methylidene-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 103069294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).