(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide

C14H26N2O2 — CID 104901402

IUPAC(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
SMILESCCC1(CC)CC(NC(=O)[C@H]2CCCN2)CCO1
InChIInChI=1S/C14H26N2O2/c1-3-14(4-2)10-11(7-9-18-14)16-13(17)12-6-5-8-15-12/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11?,12-/m1/s1
InChIKeyNAYTZXUGXNPZAE-PIJUOVFKSA-N
MW254.37 g/mol
LogP1.59
Rot. Bonds4

About (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide

(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide (PubChem CID 104901402) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
PubChem CID104901402
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
SMILESCCC1(CC)CC(NC(=O)[C@H]2CCCN2)CCO1
InChIInChI=1S/C14H26N2O2/c1-3-14(4-2)10-11(7-9-18-14)16-13(17)12-6-5-8-15-12/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11?,12-/m1/s1
InChIKeyNAYTZXUGXNPZAE-PIJUOVFKSA-N
XLogP1.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-diethyloxan-4-yl)-4-methylpiperidine-2-carboxamide
CID 114424424
N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
CID 114429439
N-(2,2-diethyloxan-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779942
N-(2,2-diethyloxan-4-yl)-2-oxo-2-piperazin-1-ylacetamide
CID 83035026
N-(2,2-diethyloxan-4-yl)pyrrolidine-1-carboxamide
CID 115865884
N-(2,2-diethyloxan-4-yl)prop-2-enamide
CID 83032720
(2S)-N-(2-ethyl-2-methylcyclopropyl)pyrrolidine-2-carboxamide
CID 131000663
N-(thian-4-yl)pyrrolidine-2-carboxamide
CID 115626530
1-amino-N-(2,2-diethyloxan-4-yl)cyclobutane-1-carboxamide
CID 83028998
N-(2,2-diethyloxan-4-yl)-3-ethylpiperidine-3-carboxamide
CID 83036475
N-(1-ethylazetidin-3-yl)pyrrolidine-2-carboxamide
CID 130638003
(2S)-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 66855012

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide (CID 104901402) is (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide is CCC1(CC)CC(NC(=O)[C@H]2CCCN2)CCO1.
What is the InChIKey of (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is NAYTZXUGXNPZAE-PIJUOVFKSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-14(4-2)10-11(7-9-18-14)16-13(17)12-6-5-8-15-12/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11?,12-/m1/s1.
What are the key properties of (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide?
(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 104901402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).