2-[3-methyl-1-(propylamino)cyclohexyl]acetamide

C12H24N2O — CID 65236102

IUPAC2-[3-methyl-1-(propylamino)cyclohexyl]acetamide
SMILESCCCNC1(CC(N)=O)CCCC(C)C1
InChIInChI=1S/C12H24N2O/c1-3-7-14-12(9-11(13)15)6-4-5-10(2)8-12/h10,14H,3-9H2,1-2H3,(H2,13,15)
InChIKeyIXNUOUAXDLIDNA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.81
Rot. Bonds5

About 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide

2-[3-methyl-1-(propylamino)cyclohexyl]acetamide (PubChem CID 65236102) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-[3-methyl-1-(propylamino)cyclohexyl]acetamide
PubChem CID65236102
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-[3-methyl-1-(propylamino)cyclohexyl]acetamide
SMILESCCCNC1(CC(N)=O)CCCC(C)C1
InChIInChI=1S/C12H24N2O/c1-3-7-14-12(9-11(13)15)6-4-5-10(2)8-12/h10,14H,3-9H2,1-2H3,(H2,13,15)
InChIKeyIXNUOUAXDLIDNA-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-propyl-1-(propylamino)cycloheptyl]acetamide
CID 65235539
2-(1-amino-3-methylcyclohexyl)acetamide
CID 165483573
2-[3-methoxy-1-(propylamino)cyclohexyl]acetic acid
CID 106874590
methyl 2-[3-propan-2-yl-1-(propylamino)cyclohexyl]acetate
CID 107450553
1-ethyl-3-methyl-N-propylcyclopentan-1-amine
CID 145367568
1-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-3-methylcyclohexane-1-carboxamide
CID 114162134
2-[[1-(hydroxymethyl)-3-methylcyclohexyl]amino]acetic acid
CID 55209144
2-[3-ethyl-1-(propylamino)cyclopentyl]acetic acid
CID 65233526
1-(chloromethyl)-3-methyl-N-octylcyclohexan-1-amine
CID 65029958
[3-(3-methylcyclohexyl)oxy-1-(propylamino)cyclohexyl]methanol
CID 79640737
methyl 4-[[1-(hydroxymethyl)-3-methylcyclohexyl]amino]butanoate
CID 62552200
[1-(2-tert-butylsulfonylethylamino)-3-methylcyclohexyl]methanol
CID 106723632

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide?
The IUPAC name of 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide (CID 65236102) is 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide.
What is the SMILES notation for 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide?
The canonical SMILES for 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide is CCCNC1(CC(N)=O)CCCC(C)C1.
What is the InChIKey of 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide?
The InChIKey is IXNUOUAXDLIDNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-7-14-12(9-11(13)15)6-4-5-10(2)8-12/h10,14H,3-9H2,1-2H3,(H2,13,15).
What are the key properties of 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide?
2-[3-methyl-1-(propylamino)cyclohexyl]acetamide has a molecular weight of 212.34 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methyl-1-(propylamino)cyclohexyl]acetamide is sourced from PubChem (CID 65236102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).