N'-[amino(methyl)amino]pentanimidamide

C6H16N4 — CID 144800598

IUPACN'-[amino(methyl)amino]pentanimidamide
SMILESCCCC/C(N)=N/N(C)N
InChIInChI=1S/C6H16N4/c1-3-4-5-6(7)9-10(2)8/h3-5,8H2,1-2H3,(H2,7,9)
InChIKeyGZXQJRRUMNCEFW-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.25
Rot. Bonds4

About N'-[amino(methyl)amino]pentanimidamide

N'-[amino(methyl)amino]pentanimidamide (PubChem CID 144800598) has the molecular formula C6H16N4 and a molecular weight of 144.22 g/mol. Its IUPAC name is N'-[amino(methyl)amino]pentanimidamide.

Molecular Properties

Compound NameN'-[amino(methyl)amino]pentanimidamide
PubChem CID144800598
Molecular FormulaC6H16N4
Molecular Weight144.22 g/mol
Exact Mass144.14
IUPAC NameN'-[amino(methyl)amino]pentanimidamide
SMILESCCCC/C(N)=N/N(C)N
InChIInChI=1S/C6H16N4/c1-3-4-5-6(7)9-10(2)8/h3-5,8H2,1-2H3,(H2,7,9)
InChIKeyGZXQJRRUMNCEFW-UHFFFAOYSA-N
XLogP0.25
TPSA67.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea
CID 143471674
N'-cyclopropylpentanimidamide
CID 79413074
N'-aminononanimidamide
CID 4100069
N'-diazenylpentanimidamide
CID 143625651
N,N'-diamino-N-methylheptanimidamide
CID 155689809
N-amino-N-nitrosopentanamide
CID 172967677
N'-hydroxy-3-[methyl(octyl)amino]propanimidamide
CID 43129496
N'-(2,2-dimethoxyethyl)pentanimidamide
CID 126622878
N'-[(C,N-dimethylcarbonimidoyl)amino]pentanimidamide
CID 123587898
4-(dimethylamino)-N'-hydroxybutanimidamide
CID 74314081
butan-1-ol;N,N-dimethylmethanamine
CID 87409376
pentanethioamide;hydrochloride
CID 140974365

Frequently Asked Questions

What is the IUPAC name of N'-[amino(methyl)amino]pentanimidamide?
The IUPAC name of N'-[amino(methyl)amino]pentanimidamide (CID 144800598) is N'-[amino(methyl)amino]pentanimidamide.
What is the SMILES notation for N'-[amino(methyl)amino]pentanimidamide?
The canonical SMILES for N'-[amino(methyl)amino]pentanimidamide is CCCC/C(N)=N/N(C)N.
What is the InChIKey of N'-[amino(methyl)amino]pentanimidamide?
The InChIKey is GZXQJRRUMNCEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N4/c1-3-4-5-6(7)9-10(2)8/h3-5,8H2,1-2H3,(H2,7,9).
What are the key properties of N'-[amino(methyl)amino]pentanimidamide?
N'-[amino(methyl)amino]pentanimidamide has a molecular weight of 144.22 g/mol, XLogP of 0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[amino(methyl)amino]pentanimidamide is sourced from PubChem (CID 144800598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).