N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide

C14H27N3O2 — CID 106980154

IUPACN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)C1(C(C)C)CCNC1
InChIInChI=1S/C14H27N3O2/c1-10(2)7-17(8-12(15)18)13(19)14(11(3)4)5-6-16-9-14/h10-11,16H,5-9H2,1-4H3,(H2,15,18)
InChIKeyACNDDVQTRSEFBH-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.59
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide

N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 106980154) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID106980154
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)C1(C(C)C)CCNC1
InChIInChI=1S/C14H27N3O2/c1-10(2)7-17(8-12(15)18)13(19)14(11(3)4)5-6-16-9-14/h10-11,16H,5-9H2,1-4H3,(H2,15,18)
InChIKeyACNDDVQTRSEFBH-UHFFFAOYSA-N
XLogP0.59
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980192
N-methyl-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979682
3-[propan-2-yl-(3-propan-2-ylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 106980309
N-hexyl-N-(2-hydroxyethyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980166
3-[tert-butyl-(3-propan-2-ylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 106980310
N-(5-amino-5-oxopentyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 114162039
3-propan-2-ylpyrrolidine-3-carbohydrazide
CID 106980734
(2R)-5-amino-5-oxo-2-[(3-propan-2-ylpyrrolidine-3-carbonyl)amino]pentanoic acid
CID 107830415
5-amino-5-oxo-2-[(3-propan-2-ylpyrrolidine-3-carbonyl)amino]pentanoic acid
CID 106980283
3-methyl-1-(3-propan-2-ylpyrrolidin-3-yl)but-3-en-1-one
CID 106982318
N-(2-hydroxyethyl)-N-pentan-3-yl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980479
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-piperidin-4-ylpropanamide
CID 62211442

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide (CID 106980154) is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide is CC(C)CN(CC(N)=O)C(=O)C1(C(C)C)CCNC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is ACNDDVQTRSEFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-10(2)7-17(8-12(15)18)13(19)14(11(3)4)5-6-16-9-14/h10-11,16H,5-9H2,1-4H3,(H2,15,18).
What are the key properties of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106980154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).