3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide

C14H27N3O2 — CID 106588660

IUPAC3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(N2CCCC(COC)C2)C1
InChIInChI=1S/C14H27N3O2/c1-16-14(13(15)18)6-5-12(8-14)17-7-3-4-11(9-17)10-19-2/h11-12,16H,3-10H2,1-2H3,(H2,15,18)
InChIKeyPKGAYVSGZNTJNR-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.34
Rot. Bonds5

About 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide

3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide (PubChem CID 106588660) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide
PubChem CID106588660
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(N2CCCC(COC)C2)C1
InChIInChI=1S/C14H27N3O2/c1-16-14(13(15)18)6-5-12(8-14)17-7-3-4-11(9-17)10-19-2/h11-12,16H,3-10H2,1-2H3,(H2,15,18)
InChIKeyPKGAYVSGZNTJNR-UHFFFAOYSA-N
XLogP0.34
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(ethylamino)-3-[3-(methoxymethyl)piperidin-1-yl]cyclopentane-1-carboxylic acid
CID 106588655
1-(ethylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexane-1-carboxamide
CID 79641984
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
1-amino-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexane-1-carboxamide
CID 79641851
3-(3,4-dimethoxypyrrolidin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 103538200
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79641560
ethyl 1-(methylamino)-3-pyrrolidin-1-ylcyclopentane-1-carboxylate
CID 79649541
3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79641394
3-(3,3-dimethylpiperidin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79641849
1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide
CID 79644633
1-(methylamino)-3-(3-propoxypiperidin-1-yl)cyclopentane-1-carboxylic acid
CID 79651259
1-amino-3-[4-(methoxymethyl)piperidin-1-yl]cyclohexane-1-carboxamide
CID 79642191

Frequently Asked Questions

What is the IUPAC name of 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide?
The IUPAC name of 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide (CID 106588660) is 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide is CNC1(C(N)=O)CCC(N2CCCC(COC)C2)C1.
What is the InChIKey of 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide?
The InChIKey is PKGAYVSGZNTJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-16-14(13(15)18)6-5-12(8-14)17-7-3-4-11(9-17)10-19-2/h11-12,16H,3-10H2,1-2H3,(H2,15,18).
What are the key properties of 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide?
3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 106588660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).