2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide

C9H20N4O2 — CID 83111827

IUPAC2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
SMILESCN(C)C(=O)NCCNC(=O)C(C)(C)N
InChIInChI=1S/C9H20N4O2/c1-9(2,10)7(14)11-5-6-12-8(15)13(3)4/h5-6,10H2,1-4H3,(H,11,14)(H,12,15)
InChIKeyKLTMSEUKTDTXKU-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.89
Rot. Bonds4

About 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide

2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide (PubChem CID 83111827) has the molecular formula C9H20N4O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
PubChem CID83111827
Molecular FormulaC9H20N4O2
Molecular Weight216.28 g/mol
Exact Mass216.16
IUPAC Name2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
SMILESCN(C)C(=O)NCCNC(=O)C(C)(C)N
InChIInChI=1S/C9H20N4O2/c1-9(2,10)7(14)11-5-6-12-8(15)13(3)4/h5-6,10H2,1-4H3,(H,11,14)(H,12,15)
InChIKeyKLTMSEUKTDTXKU-UHFFFAOYSA-N
XLogP-0.89
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide
CID 112555904
2-amino-2-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]propanamide
CID 106047758
2-amino-N-(2-fluoroethyl)-2-methylpropanamide
CID 130504084
tert-butyl N-[2-(dimethylcarbamoylamino)ethyl]carbamate
CID 78978111
2-amino-2-methyl-N-(3,3,3-trifluoropropyl)propanamide
CID 63226651
N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
CID 108575110
N-[2-(dimethylcarbamoylamino)ethyl]propanamide
CID 83117545
3-[2-[[(2S)-2,3-dihydroxypropyl]amino]ethyl]-1,1-dimethylurea
CID 83120613
N-[2-(dimethylcarbamoylamino)ethyl]-2-sulfanylacetamide
CID 83117465
(2R)-2-amino-N-[2-(dimethylcarbamoylamino)ethyl]butanamide
CID 83110467
(2S)-2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3-methylbutanamide
CID 83110298
2-amino-N-[2-(dimethylamino)-4-methylpentyl]-2-methylpropanamide
CID 61264103

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide (CID 83111827) is 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide is CN(C)C(=O)NCCNC(=O)C(C)(C)N.
What is the InChIKey of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide?
The InChIKey is KLTMSEUKTDTXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4O2/c1-9(2,10)7(14)11-5-6-12-8(15)13(3)4/h5-6,10H2,1-4H3,(H,11,14)(H,12,15).
What are the key properties of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide?
2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide has a molecular weight of 216.28 g/mol, XLogP of -0.89, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide is sourced from PubChem (CID 83111827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).