(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide

C10H20N4O2 — CID 59006500

IUPAC(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide
SMILESCNC(=O)NC[C@H]1CCCN1C(=O)N(C)C
InChIInChI=1S/C10H20N4O2/c1-11-9(15)12-7-8-5-4-6-14(8)10(16)13(2)3/h8H,4-7H2,1-3H3,(H2,11,12,15)/t8-/m1/s1
InChIKeySJIBFMUFQAZZLX-MRVPVSSYSA-N
MW228.30 g/mol
LogP0.06
Rot. Bonds2

About (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide

(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide (PubChem CID 59006500) has the molecular formula C10H20N4O2 and a molecular weight of 228.30 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide
PubChem CID59006500
Molecular FormulaC10H20N4O2
Molecular Weight228.30 g/mol
Exact Mass228.16
IUPAC Name(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide
SMILESCNC(=O)NC[C@H]1CCCN1C(=O)N(C)C
InChIInChI=1S/C10H20N4O2/c1-11-9(15)12-7-8-5-4-6-14(8)10(16)13(2)3/h8H,4-7H2,1-3H3,(H2,11,12,15)/t8-/m1/s1
InChIKeySJIBFMUFQAZZLX-MRVPVSSYSA-N
XLogP0.06
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl 2-[(methylcarbamoylamino)methyl]piperidine-1-carboxylate
CID 47442439
2-(2-hydroxypropyl)-N,N-dimethylpyrrolidine-1-carboxamide
CID 79547049
benzyl (2R)-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxylate
CID 59006552
methyl 2-[1-(dimethylcarbamoyl)piperidin-2-yl]acetate
CID 79154755
1-methyl-3-[[1-(7-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl)pyrrolidin-2-yl]methyl]urea
CID 166388059
1-[(2S)-2-(methylaminomethyl)pyrrolidin-1-yl]ethanone
CID 66569273
N-[[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidin-2-yl]methyl]acetamide
CID 66567586
1-methyl-3-[2-[(2R)-1-methylpyrrolidin-2-yl]ethyl]urea
CID 99919601
N,N-dimethyl-2-propan-2-ylpyrrolidine-1-carboxamide
CID 115593303
N,N-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide
CID 115575763
N-[[(2S)-1-acetylpyrrolidin-2-yl]methyl]-2,2,2-trifluoroacetamide
CID 143059695
2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide
CID 103441346

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide (CID 59006500) is (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide is CNC(=O)NC[C@H]1CCCN1C(=O)N(C)C.
What is the InChIKey of (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide?
The InChIKey is SJIBFMUFQAZZLX-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H20N4O2/c1-11-9(15)12-7-8-5-4-6-14(8)10(16)13(2)3/h8H,4-7H2,1-3H3,(H2,11,12,15)/t8-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide?
(2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide has a molecular weight of 228.30 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-dimethyl-2-[(methylcarbamoylamino)methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 59006500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).