2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride

C13H25ClN4O2 — CID 119926408

IUPAC2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
SMILESCNC(=O)NC(=O)CN1CCC(NCC2CC2)CC1.Cl
InChIInChI=1S/C13H24N4O2.ClH/c1-14-13(19)16-12(18)9-17-6-4-11(5-7-17)15-8-10-2-3-10;/h10-11,15H,2-9H2,1H3,(H2,14,16,18,19);1H
InChIKeyLEZNRTXVCRSPPS-UHFFFAOYSA-N
MW304.82 g/mol
LogP0.33
Rot. Bonds5

About 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride

2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride (PubChem CID 119926408) has the molecular formula C13H25ClN4O2 and a molecular weight of 304.82 g/mol. Its IUPAC name is 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
PubChem CID119926408
Molecular FormulaC13H25ClN4O2
Molecular Weight304.82 g/mol
Exact Mass304.17
IUPAC Name2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
SMILESCNC(=O)NC(=O)CN1CCC(NCC2CC2)CC1.Cl
InChIInChI=1S/C13H24N4O2.ClH/c1-14-13(19)16-12(18)9-17-6-4-11(5-7-17)15-8-10-2-3-10;/h10-11,15H,2-9H2,1H3,(H2,14,16,18,19);1H
InChIKeyLEZNRTXVCRSPPS-UHFFFAOYSA-N
XLogP0.33
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 81493119
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119922349
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 119923266
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 80552650
N-cyclopentyl-2-[4-(cyclopropylmethylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119926446
N-cyclopropyl-2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-methylacetamide;hydrochloride
CID 119926792
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 115307268
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(2,3-dimethylcyclohexyl)acetamide;hydrochloride
CID 119926459
2-[3-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119914462
N-(cyclopropylmethyl)-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 78946388
2-(4-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
CID 80703621
methyl 3-[4-[2-(methylcarbamoylamino)-2-oxoethyl]piperazin-1-yl]propanoate
CID 78982381

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride?
The IUPAC name of 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride (CID 119926408) is 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride.
What is the SMILES notation for 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride?
The canonical SMILES for 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride is CNC(=O)NC(=O)CN1CCC(NCC2CC2)CC1.Cl.
What is the InChIKey of 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride?
The InChIKey is LEZNRTXVCRSPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2.ClH/c1-14-13(19)16-12(18)9-17-6-4-11(5-7-17)15-8-10-2-3-10;/h10-11,15H,2-9H2,1H3,(H2,14,16,18,19);1H.
What are the key properties of 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride?
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 0.33, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride is sourced from PubChem (CID 119926408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).