(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide

C9H17N3O2 — CID 103807278

IUPAC(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCN(CCCN)C(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C9H17N3O2/c1-12(6-2-5-10)9(14)7-3-4-8(13)11-7/h7H,2-6,10H2,1H3,(H,11,13)/t7-/m1/s1
InChIKeyBWFNCBBBPJHVGW-SSDOTTSWSA-N
MW199.25 g/mol
LogP-0.93
Rot. Bonds4

About (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide

(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide (PubChem CID 103807278) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
PubChem CID103807278
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCN(CCCN)C(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C9H17N3O2/c1-12(6-2-5-10)9(14)7-3-4-8(13)11-7/h7H,2-6,10H2,1H3,(H,11,13)/t7-/m1/s1
InChIKeyBWFNCBBBPJHVGW-SSDOTTSWSA-N
XLogP-0.93
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(3-amino-2,2-dimethylpropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide;hydrochloride
CID 119655849
(2R)-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 103840269
(2S)-N-(3-aminopropyl)-5-oxopyrrolidine-2-carboxamide
CID 103805016
N-methyl-5-oxo-N-(piperidin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 106627526
(2S)-N-[(4-hydroxyoxan-4-yl)methyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 105359461
(2R)-N-methyl-5-oxo-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]pyrrolidine-2-carboxamide
CID 99826475
N-(3-aminopropyl)-N-methylcyclooctanecarboxamide
CID 65019001
(2R)-N-(2-aminoethyl)-N-benzyl-5-oxopyrrolidine-2-carboxamide
CID 104859504
5-(7-amino-3-methylheptanoyl)pyrrolidin-2-one
CID 58520724
N-(6-aminohexan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 59525111
N-(2-aminoethyl)-N-methyl-2-oxo-1,3-thiazolidine-4-carboxamide
CID 62686799
(2R)-N-(5-aminopentyl)-5-oxopyrrolidine-2-carboxamide
CID 170277204

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide (CID 103807278) is (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide is CN(CCCN)C(=O)[C@H]1CCC(=O)N1.
What is the InChIKey of (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
The InChIKey is BWFNCBBBPJHVGW-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-12(6-2-5-10)9(14)7-3-4-8(13)11-7/h7H,2-6,10H2,1H3,(H,11,13)/t7-/m1/s1.
What are the key properties of (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide?
(2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide has a molecular weight of 199.25 g/mol, XLogP of -0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-aminopropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 103807278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).