N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide

C14H25NO — CID 71244330

IUPACN,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide
SMILESCC(C)C1CCC2(CC(C(=O)N(C)C)C2)C1
InChIInChI=1S/C14H25NO/c1-10(2)11-5-6-14(7-11)8-12(9-14)13(16)15(3)4/h10-12H,5-9H2,1-4H3
InChIKeyIFVNXQQDRFSJQM-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.93
Rot. Bonds2

About N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide

N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide (PubChem CID 71244330) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide
PubChem CID71244330
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide
SMILESCC(C)C1CCC2(CC(C(=O)N(C)C)C2)C1
InChIInChI=1S/C14H25NO/c1-10(2)11-5-6-14(7-11)8-12(9-14)13(16)15(3)4/h10-12H,5-9H2,1-4H3
InChIKeyIFVNXQQDRFSJQM-UHFFFAOYSA-N
XLogP2.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide?
The IUPAC name of N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide (CID 71244330) is N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide?
The canonical SMILES for N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide is CC(C)C1CCC2(CC(C(=O)N(C)C)C2)C1.
What is the InChIKey of N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide?
The InChIKey is IFVNXQQDRFSJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-10(2)11-5-6-14(7-11)8-12(9-14)13(16)15(3)4/h10-12H,5-9H2,1-4H3.
What are the key properties of N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide?
N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide has a molecular weight of 223.36 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-7-propan-2-ylspiro[3.4]octane-2-carboxamide is sourced from PubChem (CID 71244330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).