imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone

C17H18N4O2 — CID 99617785

IUPACimidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone
SMILESCn1cccc1[C@H]1COCCN1C(=O)c1ccn2ccnc2c1
InChIInChI=1S/C17H18N4O2/c1-19-6-2-3-14(19)15-12-23-10-9-21(15)17(22)13-4-7-20-8-5-18-16(20)11-13/h2-8,11,15H,9-10,12H2,1H3/t15-/m1/s1
InChIKeySCKDSACDCBMKFU-OAHLLOKOSA-N
MW310.36 g/mol
LogP1.89
Rot. Bonds2

About imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone

imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone (PubChem CID 99617785) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone
PubChem CID99617785
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Nameimidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone
SMILESCn1cccc1[C@H]1COCCN1C(=O)c1ccn2ccnc2c1
InChIInChI=1S/C17H18N4O2/c1-19-6-2-3-14(19)15-12-23-10-9-21(15)17(22)13-4-7-20-8-5-18-16(20)11-13/h2-8,11,15H,9-10,12H2,1H3/t15-/m1/s1
InChIKeySCKDSACDCBMKFU-OAHLLOKOSA-N
XLogP1.89
TPSA51.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone?
The IUPAC name of imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone (CID 99617785) is imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone.
What is the SMILES notation for imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone?
The canonical SMILES for imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone is Cn1cccc1[C@H]1COCCN1C(=O)c1ccn2ccnc2c1.
What is the InChIKey of imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone?
The InChIKey is SCKDSACDCBMKFU-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-19-6-2-3-14(19)15-12-23-10-9-21(15)17(22)13-4-7-20-8-5-18-16(20)11-13/h2-8,11,15H,9-10,12H2,1H3/t15-/m1/s1.
What are the key properties of imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone?
imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone has a molecular weight of 310.36 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-7-yl-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 99617785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).