2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide

C13H26N4O2 — CID 120555425

IUPAC2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide
SMILESCCCCC(NC(N)=O)C(=O)NC1CCNCC1C
InChIInChI=1S/C13H26N4O2/c1-3-4-5-11(17-13(14)19)12(18)16-10-6-7-15-8-9(10)2/h9-11,15H,3-8H2,1-2H3,(H,16,18)(H3,14,17,19)
InChIKeyWMQAQJBORBNTGV-UHFFFAOYSA-N
MW270.38 g/mol
LogP0.33
Rot. Bonds6

About 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide

2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide (PubChem CID 120555425) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide
PubChem CID120555425
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC Name2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide
SMILESCCCCC(NC(N)=O)C(=O)NC1CCNCC1C
InChIInChI=1S/C13H26N4O2/c1-3-4-5-11(17-13(14)19)12(18)16-10-6-7-15-8-9(10)2/h9-11,15H,3-8H2,1-2H3,(H,16,18)(H3,14,17,19)
InChIKeyWMQAQJBORBNTGV-UHFFFAOYSA-N
XLogP0.33
TPSA96.25 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 50.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-(carbamoylamino)-N-(2-methylpiperidin-3-yl)hexanamide;hydrochloride
CID 120577618
(2R)-2-(carbamoylamino)-N-cyclopentylhexanamide
CID 94202974
2-butoxy-N-(3-methylpiperidin-4-yl)propanamide
CID 120553227
N-(4-aminocyclohexyl)-2-(carbamoylamino)hexanamide
CID 119475285
2-(carbamoylamino)-N-(piperidin-3-ylmethyl)hexanamide;hydrochloride
CID 119460747
N-(3-methylpiperidin-4-yl)decanamide
CID 79886452
N-(3-methylpiperidin-4-yl)-2-phenylpentanamide
CID 120556814
2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)pentanamide;hydrochloride
CID 120556998
N-(3-methylpiperidin-4-yl)-2-prop-2-enylpent-4-enamide;hydrochloride
CID 120553440
N-(3-methylpiperidin-4-yl)-2-pentylsulfonylacetamide
CID 120556023
2-(cyclohexylmethyl)-N-(3-methylpiperidin-4-yl)butanamide
CID 120553439
2-acetamido-2-cyclopentyl-N-(3-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120556382

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide?
The IUPAC name of 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide (CID 120555425) is 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide.
What is the SMILES notation for 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide?
The canonical SMILES for 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide is CCCCC(NC(N)=O)C(=O)NC1CCNCC1C.
What is the InChIKey of 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide?
The InChIKey is WMQAQJBORBNTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O2/c1-3-4-5-11(17-13(14)19)12(18)16-10-6-7-15-8-9(10)2/h9-11,15H,3-8H2,1-2H3,(H,16,18)(H3,14,17,19).
What are the key properties of 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide?
2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide has a molecular weight of 270.38 g/mol, XLogP of 0.33, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-(3-methylpiperidin-4-yl)hexanamide is sourced from PubChem (CID 120555425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).