ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate

C14H28N2O2 — CID 112543689

IUPACethyl N-(1,5-dipropylpiperidin-3-yl)carbamate
SMILESCCCC1CC(NC(=O)OCC)CN(CCC)C1
InChIInChI=1S/C14H28N2O2/c1-4-7-12-9-13(15-14(17)18-6-3)11-16(10-12)8-5-2/h12-13H,4-11H2,1-3H3,(H,15,17)
InChIKeyPHPNPBPWNXFJKY-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.63
Rot. Bonds6

About ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate

ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate (PubChem CID 112543689) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate.

Molecular Properties

Compound Nameethyl N-(1,5-dipropylpiperidin-3-yl)carbamate
PubChem CID112543689
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Nameethyl N-(1,5-dipropylpiperidin-3-yl)carbamate
SMILESCCCC1CC(NC(=O)OCC)CN(CCC)C1
InChIInChI=1S/C14H28N2O2/c1-4-7-12-9-13(15-14(17)18-6-3)11-16(10-12)8-5-2/h12-13H,4-11H2,1-3H3,(H,15,17)
InChIKeyPHPNPBPWNXFJKY-UHFFFAOYSA-N
XLogP2.63
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

methyl 3-[5-(ethoxycarbonylamino)-1-propylpiperidin-3-yl]propanoate
CID 112543702
ethyl N-(1,5-dibutylpiperidin-3-yl)carbamate
CID 112543731
ethyl N-(1-butyl-5-ethylpiperidin-3-yl)carbamate
CID 112543729
3-[3-(ethoxycarbonylamino)-5-(2-hydroxyethyl)piperidin-1-yl]propanoic acid
CID 112544123
3-[5-(methoxycarbonylamino)-1-propylpiperidin-3-yl]propanoic acid
CID 112543061
methyl N-[1-(cyclopropylmethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543409
ethyl N-(1-cyclopentyl-5-propylpiperidin-3-yl)carbamate
CID 112543963
ethyl N-[1-(cyclopropylmethyl)-5-(3-hydroxypropyl)piperidin-3-yl]carbamate
CID 112544061
methyl N-[1-(2-acetamidoethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543607
ethyl N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]carbamate
CID 112544049
ethyl N-[5-(2-hydroxyethyl)-1-methylpiperidin-3-yl]carbamate
CID 112543627
N-methyl-1,5-dipropylpiperidin-3-amine
CID 83989593

Frequently Asked Questions

What is the IUPAC name of ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate?
The IUPAC name of ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate (CID 112543689) is ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate.
What is the SMILES notation for ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate?
The canonical SMILES for ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate is CCCC1CC(NC(=O)OCC)CN(CCC)C1.
What is the InChIKey of ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate?
The InChIKey is PHPNPBPWNXFJKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-7-12-9-13(15-14(17)18-6-3)11-16(10-12)8-5-2/h12-13H,4-11H2,1-3H3,(H,15,17).
What are the key properties of ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate?
ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate has a molecular weight of 256.39 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate is sourced from PubChem (CID 112543689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).