CID 15038880

C24H27NO2 — CID 15038880

IUPAC—
SMILESc1ccc(CN2CC[C@@]3(C[C@@H]4c5ccccc5[C@H]3CC43OCCO3)C2)cc1
InChIInChI=1S/C24H27NO2/c1-2-6-18(7-3-1)16-25-11-10-23(17-25)14-22-20-9-5-4-8-19(20)21(23)15-24(22)26-12-13-27-24/h1-9,21-22H,10-17H2/t21-,22-,23-/m1/s1
InChIKeySLOJGBYJQWQBNJ-DNVJHFABSA-N
MW361.49 g/mol
LogP4.30
Rot. Bonds2

About CID 15038880

CID 15038880 (PubChem CID 15038880) has the molecular formula C24H27NO2 and a molecular weight of 361.49 g/mol.

Molecular Properties

Compound NameCID 15038880
PubChem CID15038880
Molecular FormulaC24H27NO2
Molecular Weight361.49 g/mol
Exact Mass361.20
IUPAC Name—
SMILESc1ccc(CN2CC[C@@]3(C[C@@H]4c5ccccc5[C@H]3CC43OCCO3)C2)cc1
InChIInChI=1S/C24H27NO2/c1-2-6-18(7-3-1)16-25-11-10-23(17-25)14-22-20-9-5-4-8-19(20)21(23)15-24(22)26-12-13-27-24/h1-9,21-22H,10-17H2/t21-,22-,23-/m1/s1
InChIKeySLOJGBYJQWQBNJ-DNVJHFABSA-N
XLogP4.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4'aS,8'aR)-2'-benzyl-4'a-phenylspiro[1,3-dioxolane-2,6'-3,4,5,7,8,8a-hexahydro-1H-isoquinoline]
CID 15811892
(4'aR,8'aS)-2'-benzyl-4'a-phenylspiro[1,3-dioxolane-2,6'-3,4,5,7,8,8a-hexahydro-1H-isoquinoline]
CID 15811893
2'-benzyl-4'a-phenylspiro[1,3-dioxolane-2,6'-4,5,7,8-tetrahydro-3H-isoquinoline]
CID 21219404
CID 57080109
CID 57080109
CID 57252552
CID 57252552
N-benzyl-N-methyl-1-[(8'R)-spiro[1,3-dioxolane-2,11'-tricyclo[6.2.2.02,7]dodeca-2,4,6-triene]-9'-yl]methanamine
CID 67857310
CID 67857320
CID 67857320
(4'aR)-2'-benzyl-4'a-phenylspiro[1,3-dioxolane-2,6'-4,5,7,8-tetrahydro-3H-isoquinoline]
CID 141886463
N-benzyl-N-[[8-methylidene-7-(5-methyl-2-propan-2-ylcyclohexyl)-1,4-dioxaspiro[4.5]decan-7-yl]methyl]-1-phenylmethanamine
CID 176087567

Frequently Asked Questions

What is the IUPAC name of CID 15038880?
The IUPAC name of CID 15038880 (CID 15038880) is not available.
What is the SMILES notation for CID 15038880?
The canonical SMILES for CID 15038880 is c1ccc(CN2CC[C@@]3(C[C@@H]4c5ccccc5[C@H]3CC43OCCO3)C2)cc1.
What is the InChIKey of CID 15038880?
The InChIKey is SLOJGBYJQWQBNJ-DNVJHFABSA-N. The full InChI is InChI=1S/C24H27NO2/c1-2-6-18(7-3-1)16-25-11-10-23(17-25)14-22-20-9-5-4-8-19(20)21(23)15-24(22)26-12-13-27-24/h1-9,21-22H,10-17H2/t21-,22-,23-/m1/s1.
What are the key properties of CID 15038880?
CID 15038880 has a molecular weight of 361.49 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 15038880 is sourced from PubChem (CID 15038880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).