(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide

C14H24N2O2 — CID 106608286

IUPAC(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C([C@@H]1CCCO1)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C14H24N2O2/c17-14(13-4-2-8-18-13)16(9-11-5-6-11)10-12-3-1-7-15-12/h11-13,15H,1-10H2/t12?,13-/m0/s1
InChIKeyJFDMHBGAYFNUCZ-ABLWVSNPSA-N
MW252.36 g/mol
LogP1.16
Rot. Bonds5

About (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide

(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide (PubChem CID 106608286) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
PubChem CID106608286
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C([C@@H]1CCCO1)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C14H24N2O2/c17-14(13-4-2-8-18-13)16(9-11-5-6-11)10-12-3-1-7-15-12/h11-13,15H,1-10H2/t12?,13-/m0/s1
InChIKeyJFDMHBGAYFNUCZ-ABLWVSNPSA-N
XLogP1.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide (CID 106608286) is (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide is O=C([C@@H]1CCCO1)N(CC1CC1)CC1CCCN1.
What is the InChIKey of (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide?
The InChIKey is JFDMHBGAYFNUCZ-ABLWVSNPSA-N. The full InChI is InChI=1S/C14H24N2O2/c17-14(13-4-2-8-18-13)16(9-11-5-6-11)10-12-3-1-7-15-12/h11-13,15H,1-10H2/t12?,13-/m0/s1.
What are the key properties of (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide?
(2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 106608286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).