2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide

Name: 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₆H₂₅N₃O — CID 28577554

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide

SMILESCN(CCCNCC(=O)NC1CC1)Cc1ccccc1

InChIInChI=1S/C16H25N3O/c1-19(13-14-6-3-2-4-7-14)11-5-10-17-12-16(20)18-15-8-9-15/h2-4,6-7,15,17H,5,8-13H2,1H3,(H,18,20)

InChIKeyRMOSKQLHEVNWLE-UHFFFAOYSA-N

MW275.40 g/mol

LogP1.38

Rot. Bonds9

About 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide

2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide (PubChem CID 28577554) has the molecular formula C₁₆H₂₅N₃O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name	2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide
PubChem CID	28577554
Molecular Formula	C₁₆H₂₅N₃O
Molecular Weight	275.40 g/mol
Exact Mass	275.20
IUPAC Name	2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide
SMILES	CN(CCCNCC(=O)NC1CC1)Cc1ccccc1
InChI	InChI=1S/C16H25N3O/c1-19(13-14-6-3-2-4-7-14)11-5-10-17-12-16(20)18-15-8-9-15/h2-4,6-7,15,17H,5,8-13H2,1H3,(H,18,20)
InChIKey	RMOSKQLHEVNWLE-UHFFFAOYSA-N
XLogP	1.38
TPSA	44.37 Å²
H-Bond Donors	2
H-Bond Acceptors	3
Rotatable Bonds	9
Heavy Atoms	20
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	275.40
LogP ≤ 5	1.38
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide?

The IUPAC name of 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide (CID 28577554) is 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide.

What is the SMILES notation for 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide?

The canonical SMILES for 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide is CN(CCCNCC(=O)NC1CC1)Cc1ccccc1.

What is the InChIKey of 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide?

The InChIKey is RMOSKQLHEVNWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(13-14-6-3-2-4-7-14)11-5-10-17-12-16(20)18-15-8-9-15/h2-4,6-7,15,17H,5,8-13H2,1H3,(H,18,20).

What are the key properties of 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide?

2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide has a molecular weight of 275.40 g/mol, XLogP of 1.38, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[benzyl(methyl)amino]propylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 28577554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 28577554 — identifiers, structure, computed properties (public domain)

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