ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate

C14H24N2O3 — CID 63131815

IUPACethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)C1(C)CCCNC1)C1CC1
InChIInChI=1S/C14H24N2O3/c1-3-19-12(17)9-16(11-5-6-11)13(18)14(2)7-4-8-15-10-14/h11,15H,3-10H2,1-2H3
InChIKeyYKYNDOCYIXRFDC-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.93
Rot. Bonds5

About ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate

ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate (PubChem CID 63131815) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate
PubChem CID63131815
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Nameethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)C1(C)CCCNC1)C1CC1
InChIInChI=1S/C14H24N2O3/c1-3-19-12(17)9-16(11-5-6-11)13(18)14(2)7-4-8-15-10-14/h11,15H,3-10H2,1-2H3
InChIKeyYKYNDOCYIXRFDC-UHFFFAOYSA-N
XLogP0.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The IUPAC name of ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate (CID 63131815) is ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate is CCOC(=O)CN(C(=O)C1(C)CCCNC1)C1CC1.
What is the InChIKey of ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The InChIKey is YKYNDOCYIXRFDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-19-12(17)9-16(11-5-6-11)13(18)14(2)7-4-8-15-10-14/h11,15H,3-10H2,1-2H3.
What are the key properties of ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate has a molecular weight of 268.36 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate is sourced from PubChem (CID 63131815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).