(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]

C14H19N7 — CID 166585557

IUPAC(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]
SMILESCc1nc2c(cc1-c1nnn(C)n1)CC[C@]1(CCNC1)N2
InChIInChI=1S/C14H19N7/c1-9-11(13-18-20-21(2)19-13)7-10-3-4-14(5-6-15-8-14)17-12(10)16-9/h7,15H,3-6,8H2,1-2H3,(H,16,17)/t14-/m1/s1
InChIKeyOERQUDDQVVXBOM-CQSZACIVSA-N
MW285.35 g/mol
LogP0.67
Rot. Bonds1

About (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]

(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine] (PubChem CID 166585557) has the molecular formula C14H19N7 and a molecular weight of 285.35 g/mol. Its IUPAC name is (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine].

Molecular Properties

Compound Name(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]
PubChem CID166585557
Molecular FormulaC14H19N7
Molecular Weight285.35 g/mol
Exact Mass285.17
IUPAC Name(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]
SMILESCc1nc2c(cc1-c1nnn(C)n1)CC[C@]1(CCNC1)N2
InChIInChI=1S/C14H19N7/c1-9-11(13-18-20-21(2)19-13)7-10-3-4-14(5-6-15-8-14)17-12(10)16-9/h7,15H,3-6,8H2,1-2H3,(H,16,17)/t14-/m1/s1
InChIKeyOERQUDDQVVXBOM-CQSZACIVSA-N
XLogP0.67
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]?
The IUPAC name of (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine] (CID 166585557) is (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine].
What is the SMILES notation for (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]?
The canonical SMILES for (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine] is Cc1nc2c(cc1-c1nnn(C)n1)CC[C@]1(CCNC1)N2.
What is the InChIKey of (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]?
The InChIKey is OERQUDDQVVXBOM-CQSZACIVSA-N. The full InChI is InChI=1S/C14H19N7/c1-9-11(13-18-20-21(2)19-13)7-10-3-4-14(5-6-15-8-14)17-12(10)16-9/h7,15H,3-6,8H2,1-2H3,(H,16,17)/t14-/m1/s1.
What are the key properties of (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]?
(2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine] has a molecular weight of 285.35 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-7-methyl-6-(2-methyltetrazol-5-yl)spiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine] is sourced from PubChem (CID 166585557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).