3-hydrazinylpropylcarbamic acid

C4H11N3O2 — CID 118306542

IUPAC3-hydrazinylpropylcarbamic acid
SMILESNNCCCNC(=O)O
InChIInChI=1S/C4H11N3O2/c5-7-3-1-2-6-4(8)9/h6-7H,1-3,5H2,(H,8,9)
InChIKeyUZVVNQUNMUFAOZ-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.89
Rot. Bonds4

About 3-hydrazinylpropylcarbamic acid

3-hydrazinylpropylcarbamic acid (PubChem CID 118306542) has the molecular formula C4H11N3O2 and a molecular weight of 133.15 g/mol. Its IUPAC name is 3-hydrazinylpropylcarbamic acid.

Molecular Properties

Compound Name3-hydrazinylpropylcarbamic acid
PubChem CID118306542
Molecular FormulaC4H11N3O2
Molecular Weight133.15 g/mol
Exact Mass133.09
IUPAC Name3-hydrazinylpropylcarbamic acid
SMILESNNCCCNC(=O)O
InChIInChI=1S/C4H11N3O2/c5-7-3-1-2-6-4(8)9/h6-7H,1-3,5H2,(H,8,9)
InChIKeyUZVVNQUNMUFAOZ-UHFFFAOYSA-N
XLogP-0.89
TPSA87.38 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-aminopropylcarbamic acid
CID 3023499
butylcarbamic acid
CID 3026651
5-(carbamothioylamino)pentylcarbamic acid
CID 23442541
butylcarbamic acid;zinc
CID 141049802
CID 162306513
CID 162306513
5-hydrazinylpentanoic acid
CID 175506840
3-(propoxycarbonylamino)propylcarbamic acid
CID 139823184
2-aminoethylcarbamic acid;ethane-1,2-diamine
CID 173123668
[(4S)-4-amino-5-hydroxypentyl]carbamic acid
CID 87488946
4-(methoxycarbonylamino)butylcarbamic acid
CID 139823188
5-acetyloxypentylcarbamic acid
CID 151401165
3-[bis(2-hydroxyethyl)amino]propylcarbamic acid
CID 19088424

Frequently Asked Questions

What is the IUPAC name of 3-hydrazinylpropylcarbamic acid?
The IUPAC name of 3-hydrazinylpropylcarbamic acid (CID 118306542) is 3-hydrazinylpropylcarbamic acid.
What is the SMILES notation for 3-hydrazinylpropylcarbamic acid?
The canonical SMILES for 3-hydrazinylpropylcarbamic acid is NNCCCNC(=O)O.
What is the InChIKey of 3-hydrazinylpropylcarbamic acid?
The InChIKey is UZVVNQUNMUFAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O2/c5-7-3-1-2-6-4(8)9/h6-7H,1-3,5H2,(H,8,9).
What are the key properties of 3-hydrazinylpropylcarbamic acid?
3-hydrazinylpropylcarbamic acid has a molecular weight of 133.15 g/mol, XLogP of -0.89, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinylpropylcarbamic acid is sourced from PubChem (CID 118306542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).