N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide

C9H19N5O — CID 104883956

IUPACN-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide
SMILESCCCN/C(=N\CC(=O)NC1CC1)NN
InChIInChI=1S/C9H19N5O/c1-2-5-11-9(14-10)12-6-8(15)13-7-3-4-7/h7H,2-6,10H2,1H3,(H,13,15)(H2,11,12,14)
InChIKeyWWYTWZNAKBDNIL-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.92
Rot. Bonds5

About N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide

N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide (PubChem CID 104883956) has the molecular formula C9H19N5O and a molecular weight of 213.28 g/mol. Its IUPAC name is N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide
PubChem CID104883956
Molecular FormulaC9H19N5O
Molecular Weight213.28 g/mol
Exact Mass213.16
IUPAC NameN-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide
SMILESCCCN/C(=N\CC(=O)NC1CC1)NN
InChIInChI=1S/C9H19N5O/c1-2-5-11-9(14-10)12-6-8(15)13-7-3-4-7/h7H,2-6,10H2,1H3,(H,13,15)(H2,11,12,14)
InChIKeyWWYTWZNAKBDNIL-UHFFFAOYSA-N
XLogP-0.92
TPSA91.54 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.92
H-Bond Donors ≤ 54
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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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide (CID 104883956) is N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide is CCCN/C(=N\CC(=O)NC1CC1)NN.
What is the InChIKey of N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide?
The InChIKey is WWYTWZNAKBDNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5O/c1-2-5-11-9(14-10)12-6-8(15)13-7-3-4-7/h7H,2-6,10H2,1H3,(H,13,15)(H2,11,12,14).
What are the key properties of N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide?
N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide has a molecular weight of 213.28 g/mol, XLogP of -0.92, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide is sourced from PubChem (CID 104883956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).