N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide

C19H24N4O2S — CID 56749962

IUPACN-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESO=C(NCc1cccnc1N1CCOCC1)c1ccc(C2CCCN2)s1
InChIInChI=1S/C19H24N4O2S/c24-19(17-6-5-16(26-17)15-4-2-7-20-15)22-13-14-3-1-8-21-18(14)23-9-11-25-12-10-23/h1,3,5-6,8,15,20H,2,4,7,9-13H2,(H,22,24)
InChIKeyAWVVLONSWKCNMQ-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.33
Rot. Bonds5

About N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide

N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide (PubChem CID 56749962) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
PubChem CID56749962
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC NameN-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESO=C(NCc1cccnc1N1CCOCC1)c1ccc(C2CCCN2)s1
InChIInChI=1S/C19H24N4O2S/c24-19(17-6-5-16(26-17)15-4-2-7-20-15)22-13-14-3-1-8-21-18(14)23-9-11-25-12-10-23/h1,3,5-6,8,15,20H,2,4,7,9-13H2,(H,22,24)
InChIKeyAWVVLONSWKCNMQ-UHFFFAOYSA-N
XLogP2.33
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The IUPAC name of N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide (CID 56749962) is N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide.
What is the SMILES notation for N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The canonical SMILES for N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide is O=C(NCc1cccnc1N1CCOCC1)c1ccc(C2CCCN2)s1.
What is the InChIKey of N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The InChIKey is AWVVLONSWKCNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c24-19(17-6-5-16(26-17)15-4-2-7-20-15)22-13-14-3-1-8-21-18(14)23-9-11-25-12-10-23/h1,3,5-6,8,15,20H,2,4,7,9-13H2,(H,22,24).
What are the key properties of N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide has a molecular weight of 372.49 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 56749962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).