(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine

C15H23N3O — CID 174363933

IUPAC(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine
SMILESCc1cnc2c(c1)[C@H](N)C1(CCN(C(C)C)CC1)O2
InChIInChI=1S/C15H23N3O/c1-10(2)18-6-4-15(5-7-18)13(16)12-8-11(3)9-17-14(12)19-15/h8-10,13H,4-7,16H2,1-3H3/t13-/m0/s1
InChIKeyNSBWCHSMISXIGF-ZDUSSCGKSA-N
MW261.37 g/mol
LogP2.03
Rot. Bonds1

About (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine

(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine (PubChem CID 174363933) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine.

Molecular Properties

Compound Name(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine
PubChem CID174363933
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine
SMILESCc1cnc2c(c1)[C@H](N)C1(CCN(C(C)C)CC1)O2
InChIInChI=1S/C15H23N3O/c1-10(2)18-6-4-15(5-7-18)13(16)12-8-11(3)9-17-14(12)19-15/h8-10,13H,4-7,16H2,1-3H3/t13-/m0/s1
InChIKeyNSBWCHSMISXIGF-ZDUSSCGKSA-N
XLogP2.03
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine?
The IUPAC name of (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine (CID 174363933) is (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine.
What is the SMILES notation for (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine?
The canonical SMILES for (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine is Cc1cnc2c(c1)[C@H](N)C1(CCN(C(C)C)CC1)O2.
What is the InChIKey of (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine?
The InChIKey is NSBWCHSMISXIGF-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H23N3O/c1-10(2)18-6-4-15(5-7-18)13(16)12-8-11(3)9-17-14(12)19-15/h8-10,13H,4-7,16H2,1-3H3/t13-/m0/s1.
What are the key properties of (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine?
(3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine has a molecular weight of 261.37 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-5-methyl-1'-propan-2-ylspiro[3H-furo[2,3-b]pyridine-2,4'-piperidine]-3-amine is sourced from PubChem (CID 174363933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).