N'-cyclopropyl-N-(3-methoxypropyl)propanediamide

C10H18N2O3 — CID 108940973

IUPACN'-cyclopropyl-N-(3-methoxypropyl)propanediamide
SMILESCOCCCNC(=O)CC(=O)NC1CC1
InChIInChI=1S/C10H18N2O3/c1-15-6-2-5-11-9(13)7-10(14)12-8-3-4-8/h8H,2-7H2,1H3,(H,11,13)(H,12,14)
InChIKeyPHZRPGVHSOFPOG-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.19
Rot. Bonds7

About N'-cyclopropyl-N-(3-methoxypropyl)propanediamide

N'-cyclopropyl-N-(3-methoxypropyl)propanediamide (PubChem CID 108940973) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N'-cyclopropyl-N-(3-methoxypropyl)propanediamide.

Molecular Properties

Compound NameN'-cyclopropyl-N-(3-methoxypropyl)propanediamide
PubChem CID108940973
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN'-cyclopropyl-N-(3-methoxypropyl)propanediamide
SMILESCOCCCNC(=O)CC(=O)NC1CC1
InChIInChI=1S/C10H18N2O3/c1-15-6-2-5-11-9(13)7-10(14)12-8-3-4-8/h8H,2-7H2,1H3,(H,11,13)(H,12,14)
InChIKeyPHZRPGVHSOFPOG-UHFFFAOYSA-N
XLogP-0.19
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N'-cyclohexyl-N-(3-methoxypropyl)propanediamide
CID 108942501
N'-cyclopropyl-N-[3-(dimethylamino)propyl]propanediamide
CID 108940978
N-cyclopropyl-N'-(3-methoxypropyl)-2,2-dimethylpropanediamide
CID 108957380
N-cyclohexyl-2-(3-methoxypropylamino)acetamide
CID 43089974
2-(cyclohexylcarbamoylamino)-N-(3-methoxypropyl)acetamide
CID 47318586
N'-cyclopentyl-N-pentylpropanediamide
CID 108942192
N-[2-(3-methoxypropylamino)-2-oxoethyl]cyclopropanecarboxamide
CID 110687120
2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 47127449
1-cyclobutyl-3-(4-methoxybutyl)urea
CID 84519072
3-(cycloheptylamino)-N-(3-methoxypropyl)propanamide
CID 109015383
N-cyclopropyl-3-[2-(3-methoxypropoxy)ethylamino]propanamide
CID 103179172
2-[acetyl(cyclohexyl)amino]-N-(3-methoxypropyl)acetamide
CID 113159417

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N-(3-methoxypropyl)propanediamide?
The IUPAC name of N'-cyclopropyl-N-(3-methoxypropyl)propanediamide (CID 108940973) is N'-cyclopropyl-N-(3-methoxypropyl)propanediamide.
What is the SMILES notation for N'-cyclopropyl-N-(3-methoxypropyl)propanediamide?
The canonical SMILES for N'-cyclopropyl-N-(3-methoxypropyl)propanediamide is COCCCNC(=O)CC(=O)NC1CC1.
What is the InChIKey of N'-cyclopropyl-N-(3-methoxypropyl)propanediamide?
The InChIKey is PHZRPGVHSOFPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-15-6-2-5-11-9(13)7-10(14)12-8-3-4-8/h8H,2-7H2,1H3,(H,11,13)(H,12,14).
What are the key properties of N'-cyclopropyl-N-(3-methoxypropyl)propanediamide?
N'-cyclopropyl-N-(3-methoxypropyl)propanediamide has a molecular weight of 214.26 g/mol, XLogP of -0.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N-(3-methoxypropyl)propanediamide is sourced from PubChem (CID 108940973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).