N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride

C12H25ClN4O2 — CID 119928173

IUPACN-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride
SMILESCCNCC1CCN(C(C)C(=O)NC(N)=O)CC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-3-14-8-10-4-6-16(7-5-10)9(2)11(17)15-12(13)18;/h9-10,14H,3-8H2,1-2H3,(H3,13,15,17,18);1H
InChIKeyGBOUHOYYODBIEC-UHFFFAOYSA-N
MW292.81 g/mol
LogP0.31
Rot. Bonds5

About N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride

N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride (PubChem CID 119928173) has the molecular formula C12H25ClN4O2 and a molecular weight of 292.81 g/mol. Its IUPAC name is N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride
PubChem CID119928173
Molecular FormulaC12H25ClN4O2
Molecular Weight292.81 g/mol
Exact Mass292.17
IUPAC NameN-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride
SMILESCCNCC1CCN(C(C)C(=O)NC(N)=O)CC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-3-14-8-10-4-6-16(7-5-10)9(2)11(17)15-12(13)18;/h9-10,14H,3-8H2,1-2H3,(H3,13,15,17,18);1H
InChIKeyGBOUHOYYODBIEC-UHFFFAOYSA-N
XLogP0.31
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(ethylaminomethyl)piperidin-1-yl]-N-propylpropanamide;hydrochloride
CID 119928199
3-[1-[1-(carbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]propanoic acid
CID 62216175
N-carbamoyl-2-[4-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 55256660
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-methoxypropyl)propanamide
CID 63847171
2-[4-(2-aminoethoxy)piperidin-1-yl]-N-carbamoylpropanamide
CID 82692623
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-carbamoylpropanamide
CID 112630191
(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide
CID 95155506
N-ethyl-2-[4-(methylaminomethyl)piperidin-1-yl]propanamide
CID 63249433
2-[4-[(2-methylpropylamino)methyl]piperidin-1-yl]propanamide
CID 63848440
1-[1-(carbamoylamino)-1-oxopropan-2-yl]-N-pentan-2-ylpiperidine-3-carboxamide
CID 49444435
2-[4-(1-aminopropan-2-yl)piperazin-1-yl]-N-carbamoylpropanamide
CID 63339692
2-(4-benzylpiperidin-1-yl)-1-[4-(ethylaminomethyl)piperidin-1-yl]propan-1-one;dihydrochloride
CID 119646213

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride?
The IUPAC name of N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride (CID 119928173) is N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride.
What is the SMILES notation for N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride?
The canonical SMILES for N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride is CCNCC1CCN(C(C)C(=O)NC(N)=O)CC1.Cl.
What is the InChIKey of N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride?
The InChIKey is GBOUHOYYODBIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2.ClH/c1-3-14-8-10-4-6-16(7-5-10)9(2)11(17)15-12(13)18;/h9-10,14H,3-8H2,1-2H3,(H3,13,15,17,18);1H.
What are the key properties of N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride?
N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 0.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[4-(ethylaminomethyl)piperidin-1-yl]propanamide;hydrochloride is sourced from PubChem (CID 119928173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).