3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide

C9H18N4O2 — CID 119344677

IUPAC3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(NC(=O)CN)C1
InChIInChI=1S/C9H18N4O2/c1-2-11-9(15)13-4-3-7(6-13)12-8(14)5-10/h7H,2-6,10H2,1H3,(H,11,15)(H,12,14)
InChIKeyFQDRKYLBDGMFSF-UHFFFAOYSA-N
MW214.27 g/mol
LogP-1.13
Rot. Bonds3

About 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide

3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide (PubChem CID 119344677) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide
PubChem CID119344677
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC Name3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(NC(=O)CN)C1
InChIInChI=1S/C9H18N4O2/c1-2-11-9(15)13-4-3-7(6-13)12-8(14)5-10/h7H,2-6,10H2,1H3,(H,11,15)(H,12,14)
InChIKeyFQDRKYLBDGMFSF-UHFFFAOYSA-N
XLogP-1.13
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(7-aminoheptanoylamino)-N-ethylpyrrolidine-1-carboxamide
CID 119820641
3-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-N-ethylpyrrolidine-1-carboxamide
CID 119820661
N-ethyl-3-(propylsulfonylamino)pyrrolidine-1-carboxamide
CID 154750307
3-[(5-amino-2-methylbenzoyl)amino]-N-ethylpyrrolidine-1-carboxamide;hydrochloride
CID 120638870
2-(aminomethyl)-N-[1-(ethylcarbamoyl)pyrrolidin-3-yl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119820666
2-(2-aminoethyl)-N-[1-(ethylcarbamoyl)pyrrolidin-3-yl]-1,3-thiazole-4-carboxamide
CID 120638873
3-[[2-(6-ethoxy-2-pyridinyl)acetyl]amino]-N-ethylpyrrolidine-1-carboxamide
CID 136539579
(3S)-N-ethyl-3-(methylamino)piperidine-1-carboxamide;hydrochloride
CID 172646385
N-[(3R)-1-(ethylcarbamoyl)pyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 97099923
N-[1-(ethylcarbamoyl)pyrrolidin-3-yl]-2-propan-2-yl-1H-pyrrole-3-carboxamide
CID 154740001
N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]propanamide
CID 110871450
2-amino-N-[1-(3-phenylpropanoyl)pyrrolidin-3-yl]acetamide;hydrochloride
CID 119339216

Frequently Asked Questions

What is the IUPAC name of 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide?
The IUPAC name of 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide (CID 119344677) is 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide is CCNC(=O)N1CCC(NC(=O)CN)C1.
What is the InChIKey of 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide?
The InChIKey is FQDRKYLBDGMFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2/c1-2-11-9(15)13-4-3-7(6-13)12-8(14)5-10/h7H,2-6,10H2,1H3,(H,11,15)(H,12,14).
What are the key properties of 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide?
3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide has a molecular weight of 214.27 g/mol, XLogP of -1.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-aminoacetyl)amino]-N-ethylpyrrolidine-1-carboxamide is sourced from PubChem (CID 119344677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).