2-amino-6-(carbamoylamino)-N-methylhexanamide

C8H18N4O2 — CID 137464971

IUPAC2-amino-6-(carbamoylamino)-N-methylhexanamide
SMILESCNC(=O)C(N)CCCCNC(N)=O
InChIInChI=1S/C8H18N4O2/c1-11-7(13)6(9)4-2-3-5-12-8(10)14/h6H,2-5,9H2,1H3,(H,11,13)(H3,10,12,14)
InChIKeySUNLKXMONFDPAD-UHFFFAOYSA-N
MW202.26 g/mol
LogP-1.10
Rot. Bonds6

About 2-amino-6-(carbamoylamino)-N-methylhexanamide

2-amino-6-(carbamoylamino)-N-methylhexanamide (PubChem CID 137464971) has the molecular formula C8H18N4O2 and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-amino-6-(carbamoylamino)-N-methylhexanamide.

Molecular Properties

Compound Name2-amino-6-(carbamoylamino)-N-methylhexanamide
PubChem CID137464971
Molecular FormulaC8H18N4O2
Molecular Weight202.26 g/mol
Exact Mass202.14
IUPAC Name2-amino-6-(carbamoylamino)-N-methylhexanamide
SMILESCNC(=O)C(N)CCCCNC(N)=O
InChIInChI=1S/C8H18N4O2/c1-11-7(13)6(9)4-2-3-5-12-8(10)14/h6H,2-5,9H2,1H3,(H,11,13)(H3,10,12,14)
InChIKeySUNLKXMONFDPAD-UHFFFAOYSA-N
XLogP-1.10
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 5-1.10
H-Bond Donors ≤ 54
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-6-hydrazinyl-N-methylhexanamide
CID 167194114
2-acetamido-6-(carbamoylamino)-N-methylhexanamide
CID 177168522
2,6-diamino-N-methylhexanamide;ethane
CID 142474602
2-amino-N-methyltetradecanamide
CID 88912425
(2S)-2-amino-N-(2-amino-2-oxoethyl)-5-(carbamoylamino)pentanamide
CID 18609889
(2R)-2-amino-6-(methylamino)-N-(5-methylhexyl)hexanamide
CID 175614226
(2S)-2-amino-N,6-dimethylheptanamide
CID 166554166
(2R)-2-amino-5-(carbamoylamino)pentanamide
CID 129140717
(4-amino-5-oxohexyl)urea;ethane
CID 145237808
2,6-diamino-N-[10-(2,6-diaminohexanoylamino)decyl]hexanamide
CID 4011235
(2S)-2,6-diamino-N-[6-[[(2S)-2,6-diaminohexanoyl]amino]hexyl]hexanamide
CID 100984594
(2S)-2-amino-N-methylhexanamide;hydrochloride
CID 141190381

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(carbamoylamino)-N-methylhexanamide?
The IUPAC name of 2-amino-6-(carbamoylamino)-N-methylhexanamide (CID 137464971) is 2-amino-6-(carbamoylamino)-N-methylhexanamide.
What is the SMILES notation for 2-amino-6-(carbamoylamino)-N-methylhexanamide?
The canonical SMILES for 2-amino-6-(carbamoylamino)-N-methylhexanamide is CNC(=O)C(N)CCCCNC(N)=O.
What is the InChIKey of 2-amino-6-(carbamoylamino)-N-methylhexanamide?
The InChIKey is SUNLKXMONFDPAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O2/c1-11-7(13)6(9)4-2-3-5-12-8(10)14/h6H,2-5,9H2,1H3,(H,11,13)(H3,10,12,14).
What are the key properties of 2-amino-6-(carbamoylamino)-N-methylhexanamide?
2-amino-6-(carbamoylamino)-N-methylhexanamide has a molecular weight of 202.26 g/mol, XLogP of -1.10, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(carbamoylamino)-N-methylhexanamide is sourced from PubChem (CID 137464971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).