N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide

C12H24N4O2 — CID 43179746

IUPACN-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
SMILESCC1CCCCN1CCCNCC(=O)NC(N)=O
InChIInChI=1S/C12H24N4O2/c1-10-5-2-3-7-16(10)8-4-6-14-9-11(17)15-12(13)18/h10,14H,2-9H2,1H3,(H3,13,15,17,18)
InChIKeyQGTQIHHNSLLUMD-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.04
Rot. Bonds6

About N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide

N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide (PubChem CID 43179746) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
PubChem CID43179746
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC NameN-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
SMILESCC1CCCCN1CCCNCC(=O)NC(N)=O
InChIInChI=1S/C12H24N4O2/c1-10-5-2-3-7-16(10)8-4-6-14-9-11(17)15-12(13)18/h10,14H,2-9H2,1H3,(H3,13,15,17,18)
InChIKeyQGTQIHHNSLLUMD-UHFFFAOYSA-N
XLogP0.04
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylbutan-2-yl)-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
CID 60696032
N-(3-methylbutyl)-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
CID 60673190
2-methyl-3-[3-(2-methylpiperidin-1-yl)propylamino]propanamide
CID 43312067
N,N-diethyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide
CID 43179739
methyl 3-[3-(2-methylpiperidin-1-yl)propylamino]propanoate
CID 43174199
methyl 2,2-dimethyl-3-[3-(2-methylpiperidin-1-yl)propylamino]propanoate
CID 79629128
3-(2-methylpiperidin-1-yl)-N-propylpropan-1-amine
CID 43193223
N-[3-(2-methylpiperidin-1-yl)propyl]cyclopropanecarboxamide
CID 60668524
3-(2-methylpiperidin-1-yl)propanehydrazide
CID 60676133
3-(2-methylpiperidin-1-yl)-N-(3-methylsulfonylpropyl)propan-1-amine
CID 63190466
methyl 2-cyclopropyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetate
CID 103233428
tert-butyl N-[3-[3-(2-methylpiperidin-1-yl)propylamino]propyl]carbamate
CID 103821611

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide?
The IUPAC name of N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide (CID 43179746) is N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide?
The canonical SMILES for N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide is CC1CCCCN1CCCNCC(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide?
The InChIKey is QGTQIHHNSLLUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-10-5-2-3-7-16(10)8-4-6-14-9-11(17)15-12(13)18/h10,14H,2-9H2,1H3,(H3,13,15,17,18).
What are the key properties of N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide?
N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide has a molecular weight of 256.35 g/mol, XLogP of 0.04, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[3-(2-methylpiperidin-1-yl)propylamino]acetamide is sourced from PubChem (CID 43179746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).