3-[cyclopropylmethyl(propyl)amino]propanimidamide

C10H21N3 — CID 61441845

IUPAC3-[cyclopropylmethyl(propyl)amino]propanimidamide
SMILES[H]/N=C(\N)CCN(CCC)CC1CC1
InChIInChI=1S/C10H21N3/c1-2-6-13(7-5-10(11)12)8-9-3-4-9/h9H,2-8H2,1H3,(H3,11,12)
InChIKeyGDUVQRYMNAWNFL-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.43
Rot. Bonds7

About 3-[cyclopropylmethyl(propyl)amino]propanimidamide

3-[cyclopropylmethyl(propyl)amino]propanimidamide (PubChem CID 61441845) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 3-[cyclopropylmethyl(propyl)amino]propanimidamide.

Molecular Properties

Compound Name3-[cyclopropylmethyl(propyl)amino]propanimidamide
PubChem CID61441845
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name3-[cyclopropylmethyl(propyl)amino]propanimidamide
SMILES[H]/N=C(\N)CCN(CCC)CC1CC1
InChIInChI=1S/C10H21N3/c1-2-6-13(7-5-10(11)12)8-9-3-4-9/h9H,2-8H2,1H3,(H3,11,12)
InChIKeyGDUVQRYMNAWNFL-UHFFFAOYSA-N
XLogP1.43
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-[cyclopropylmethyl(propyl)amino]propanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropylmethyl(propyl)amino]propanimidamide?
The IUPAC name of 3-[cyclopropylmethyl(propyl)amino]propanimidamide (CID 61441845) is 3-[cyclopropylmethyl(propyl)amino]propanimidamide.
What is the SMILES notation for 3-[cyclopropylmethyl(propyl)amino]propanimidamide?
The canonical SMILES for 3-[cyclopropylmethyl(propyl)amino]propanimidamide is [H]/N=C(\N)CCN(CCC)CC1CC1.
What is the InChIKey of 3-[cyclopropylmethyl(propyl)amino]propanimidamide?
The InChIKey is GDUVQRYMNAWNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-2-6-13(7-5-10(11)12)8-9-3-4-9/h9H,2-8H2,1H3,(H3,11,12).
What are the key properties of 3-[cyclopropylmethyl(propyl)amino]propanimidamide?
3-[cyclopropylmethyl(propyl)amino]propanimidamide has a molecular weight of 183.30 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropylmethyl(propyl)amino]propanimidamide is sourced from PubChem (CID 61441845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).