4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide

C10H20N2O2 — CID 66251169

IUPAC4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide
SMILESCC(C)N(C)C(=O)C1(C)COCC1N
InChIInChI=1S/C10H20N2O2/c1-7(2)12(4)9(13)10(3)6-14-5-8(10)11/h7-8H,5-6,11H2,1-4H3
InChIKeyKAHZSFJDSBNBPA-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.22
Rot. Bonds2

About 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide

4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide (PubChem CID 66251169) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide
PubChem CID66251169
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide
SMILESCC(C)N(C)C(=O)C1(C)COCC1N
InChIInChI=1S/C10H20N2O2/c1-7(2)12(4)9(13)10(3)6-14-5-8(10)11/h7-8H,5-6,11H2,1-4H3
InChIKeyKAHZSFJDSBNBPA-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide?
The IUPAC name of 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide (CID 66251169) is 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide is CC(C)N(C)C(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide?
The InChIKey is KAHZSFJDSBNBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)12(4)9(13)10(3)6-14-5-8(10)11/h7-8H,5-6,11H2,1-4H3.
What are the key properties of 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide?
4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,3-dimethyl-N-propan-2-yloxolane-3-carboxamide is sourced from PubChem (CID 66251169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).