(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide

C7H15N3O2 — CID 59006567

IUPAC(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide
SMILESCNC(=O)N[C@H](C)C(=O)N(C)C
InChIInChI=1S/C7H15N3O2/c1-5(6(11)10(3)4)9-7(12)8-2/h5H,1-4H3,(H2,8,9,12)/t5-/m1/s1
InChIKeyCCMNOQMFBXPXHO-RXMQYKEDSA-N
MW173.22 g/mol
LogP-0.61
Rot. Bonds2

About (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide

(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide (PubChem CID 59006567) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide
PubChem CID59006567
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide
SMILESCNC(=O)N[C@H](C)C(=O)N(C)C
InChIInChI=1S/C7H15N3O2/c1-5(6(11)10(3)4)9-7(12)8-2/h5H,1-4H3,(H2,8,9,12)/t5-/m1/s1
InChIKeyCCMNOQMFBXPXHO-RXMQYKEDSA-N
XLogP-0.61
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-[1-(dimethylamino)-1-oxopropan-2-yl]carbamate
CID 13269666
2-(2-chloropropanoylamino)-N,N-dimethylpropanamide
CID 43578901
N-[1-(dimethylamino)-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 60730592
(2R)-N,N-dimethyl-2-[[(2S)-octan-2-yl]carbamoylamino]propanamide
CID 97027546
(2R)-2-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoylamino]pentanoic acid
CID 107566462
2-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoylamino]-3-methylpentanoic acid
CID 61465815
N,N-dimethyl-2-(propan-2-ylamino)propanamide
CID 43085810
2-bromo-N-[1-(dimethylamino)-1-oxopropan-2-yl]-3-methylbutanamide
CID 43578902
2-[(4-aminophenyl)carbamoylamino]-N,N-dimethylpropanamide
CID 54955307
(2S)-4-amino-2-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoylamino]-4-oxobutanoic acid
CID 55230557
2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
CID 43579388
4-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoylamino]-2,2-dimethyl-4-oxobutanoic acid
CID 65300087

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide?
The IUPAC name of (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide (CID 59006567) is (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide.
What is the SMILES notation for (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide?
The canonical SMILES for (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide is CNC(=O)N[C@H](C)C(=O)N(C)C.
What is the InChIKey of (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide?
The InChIKey is CCMNOQMFBXPXHO-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H15N3O2/c1-5(6(11)10(3)4)9-7(12)8-2/h5H,1-4H3,(H2,8,9,12)/t5-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide?
(2R)-N,N-dimethyl-2-(methylcarbamoylamino)propanamide has a molecular weight of 173.22 g/mol, XLogP of -0.61, 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)propanamide is sourced from PubChem (CID 59006567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).