N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide

C13H25N3O — CID 103814322

IUPACN-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide
SMILESCCN(CCNC(=O)CNCC1CC1)C1CC1
InChIInChI=1S/C13H25N3O/c1-2-16(12-5-6-12)8-7-15-13(17)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyIYBPHNLUCWMSIT-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.59
Rot. Bonds9

About N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide

N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide (PubChem CID 103814322) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide.

Molecular Properties

Compound NameN-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide
PubChem CID103814322
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide
SMILESCCN(CCNC(=O)CNCC1CC1)C1CC1
InChIInChI=1S/C13H25N3O/c1-2-16(12-5-6-12)8-7-15-13(17)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyIYBPHNLUCWMSIT-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-[2-[cyclopropyl(methyl)amino]ethyl]acetamide;dihydrochloride
CID 119863864
2-(cyclopropylmethylamino)-N-[2-[ethyl(propyl)amino]ethyl]acetamide;dihydrochloride
CID 119896212
1-[2-[cyclopropyl(ethyl)amino]ethyl]-3-(cyclopropylmethyl)-2-methylguanidine
CID 111869610
N-(2-acetamidoethyl)-2-(cyclopropylmethylamino)acetamide
CID 60867423
N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-(methylamino)butanamide;dihydrochloride
CID 119874340
2-[(4-hydroxycyclohexyl)methylamino]-N-propylacetamide
CID 106133332
(2S)-2-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]propanamide
CID 103814330
N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-methylpiperidine-1-carboxamide
CID 113229953
N-cyclopropyl-2-(cyclopropylmethylamino)-N-ethylacetamide
CID 60843358
2-(cyclopropylmethylamino)-N-(3-cyclopropylpropyl)acetamide
CID 115740556
N'-cyclopropyl-N-(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 60867855
N-(2-cyclobutylethyl)-2-(cyclopropylmethylamino)acetamide
CID 115739981

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide?
The IUPAC name of N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide (CID 103814322) is N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide.
What is the SMILES notation for N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide?
The canonical SMILES for N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide is CCN(CCNC(=O)CNCC1CC1)C1CC1.
What is the InChIKey of N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide?
The InChIKey is IYBPHNLUCWMSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-16(12-5-6-12)8-7-15-13(17)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide?
N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide has a molecular weight of 239.36 g/mol, XLogP of 0.59, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-(cyclopropylmethylamino)acetamide is sourced from PubChem (CID 103814322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).