N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide

C19H25N3O3 — CID 118788788

IUPACN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
SMILESCc1cccnc1CC(C)NC(=O)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C19H25N3O3/c1-14-4-3-5-20-18(14)10-15(2)21-19(23)16-11-17(25-13-16)12-22-6-8-24-9-7-22/h3-5,11,13,15H,6-10,12H2,1-2H3,(H,21,23)
InChIKeyPQCLMWPEMBUMLX-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.18
Rot. Bonds6

About N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide

N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide (PubChem CID 118788788) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
PubChem CID118788788
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
SMILESCc1cccnc1CC(C)NC(=O)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C19H25N3O3/c1-14-4-3-5-20-18(14)10-15(2)21-19(23)16-11-17(25-13-16)12-22-6-8-24-9-7-22/h3-5,11,13,15H,6-10,12H2,1-2H3,(H,21,23)
InChIKeyPQCLMWPEMBUMLX-UHFFFAOYSA-N
XLogP2.18
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The IUPAC name of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide (CID 118788788) is N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The canonical SMILES for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide is Cc1cccnc1CC(C)NC(=O)c1coc(CN2CCOCC2)c1.
What is the InChIKey of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The InChIKey is PQCLMWPEMBUMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14-4-3-5-20-18(14)10-15(2)21-19(23)16-11-17(25-13-16)12-22-6-8-24-9-7-22/h3-5,11,13,15H,6-10,12H2,1-2H3,(H,21,23).
What are the key properties of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 118788788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).