cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane

C14H28N2O2 — CID 142327053

IUPACcyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane
SMILESCC.CN1CCC(C)(NC(=O)OCC2CC2)CC1
InChIInChI=1S/C12H22N2O2.C2H6/c1-12(5-7-14(2)8-6-12)13-11(15)16-9-10-3-4-10;1-2/h10H,3-9H2,1-2H3,(H,13,15);1-2H3
InChIKeyNOVVMWNBMSTGAX-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.63
Rot. Bonds3

About cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane

cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane (PubChem CID 142327053) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane.

Molecular Properties

Compound Namecyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane
PubChem CID142327053
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Namecyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane
SMILESCC.CN1CCC(C)(NC(=O)OCC2CC2)CC1
InChIInChI=1S/C12H22N2O2.C2H6/c1-12(5-7-14(2)8-6-12)13-11(15)16-9-10-3-4-10;1-2/h10H,3-9H2,1-2H3,(H,13,15);1-2H3
InChIKeyNOVVMWNBMSTGAX-UHFFFAOYSA-N
XLogP2.63
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane
CID 142326878
(1,4-dimethylpiperidin-4-yl)urea
CID 90712934
N-(1,4-dimethylpiperidin-4-yl)-3,3-dimethylbutanamide;ethane
CID 142327060
(1-methylpiperidin-4-yl)methyl 4-methylpiperidine-4-carboxylate
CID 144963019
1-(1,4-dimethylpiperidin-4-yl)-3-(2-methylpropyl)urea
CID 134434403
tert-butyl N-[1-[(1,4-dimethylpiperidin-4-yl)carbamoyl]cyclopropyl]carbamate
CID 134435769
ethyl N-(1-methylcyclopropyl)carbamate;fluorocyclopentane
CID 169143693
4-(aminomethyl)-N-(1-methylcyclopropyl)cyclohexane-1-carboxamide
CID 104963781
2-(2-aminoethoxy)-N-[(1,4-dimethylpiperidin-4-yl)methyl]acetamide
CID 107164001
cyclopropylmethyl methyl carbonate
CID 54535586
N-(1,4-dimethylpiperidin-4-yl)-2-morpholin-4-ylacetamide
CID 142326973
1-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 65465788

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane?
The IUPAC name of cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane (CID 142327053) is cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane.
What is the SMILES notation for cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane?
The canonical SMILES for cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane is CC.CN1CCC(C)(NC(=O)OCC2CC2)CC1.
What is the InChIKey of cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane?
The InChIKey is NOVVMWNBMSTGAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.C2H6/c1-12(5-7-14(2)8-6-12)13-11(15)16-9-10-3-4-10;1-2/h10H,3-9H2,1-2H3,(H,13,15);1-2H3.
What are the key properties of cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane?
cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane has a molecular weight of 256.39 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethyl N-(1,4-dimethylpiperidin-4-yl)carbamate;ethane is sourced from PubChem (CID 142327053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).