N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide

C15H27N3O2 — CID 65242353

IUPACN-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)CC1(NC)CCCCC1
InChIInChI=1S/C15H27N3O2/c1-16-14(20)12-7-6-10-18(12)13(19)11-15(17-2)8-4-3-5-9-15/h12,17H,3-11H2,1-2H3,(H,16,20)
InChIKeySYVSGXFJIDOXRB-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.04
Rot. Bonds4

About N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide

N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide (PubChem CID 65242353) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide
PubChem CID65242353
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)CC1(NC)CCCCC1
InChIInChI=1S/C15H27N3O2/c1-16-14(20)12-7-6-10-18(12)13(19)11-15(17-2)8-4-3-5-9-15/h12,17H,3-11H2,1-2H3,(H,16,20)
InChIKeySYVSGXFJIDOXRB-UHFFFAOYSA-N
XLogP1.04
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxylate
CID 65242396
1-[2-(1-hydroxycyclohexyl)acetyl]-N-methylpiperidine-2-carboxamide
CID 111536630
1-(2-ethylpyrrolidin-1-yl)-2-[1-(methylamino)cyclohexyl]ethanone
CID 65242450
N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]piperidine-3-carboxamide
CID 103195278
3-[2-(methylcarbamoyl)pyrrolidin-1-yl]-3-oxopropanoic acid
CID 62229916
1-butanoyl-N-methylpyrrolidine-2-carboxamide
CID 61060939
N-methyl-1-[4-(methylamino)butanoyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119736624
(2S)-1-(2-acetamidoacetyl)-N-methylpyrrolidine-2-carboxamide
CID 71346691
2-[2-[2-(methylcarbamoyl)pyrrolidin-1-yl]-2-oxoethyl]sulfanylacetic acid
CID 112685367
1-[2-(cyclopentylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
CID 60952576
1-(5-chloropentanoyl)-N-methylpyrrolidine-2-carboxamide
CID 60949379
1-(3-aminobutanoyl)-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119736640

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide (CID 65242353) is N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide is CNC(=O)C1CCCN1C(=O)CC1(NC)CCCCC1.
What is the InChIKey of N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide?
The InChIKey is SYVSGXFJIDOXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-16-14(20)12-7-6-10-18(12)13(19)11-15(17-2)8-4-3-5-9-15/h12,17H,3-11H2,1-2H3,(H,16,20).
What are the key properties of N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide?
N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-[1-(methylamino)cyclohexyl]acetyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 65242353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).