6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide

C19H23N5O — CID 154735988

IUPAC6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)cn1)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C19H23N5O/c25-19(15-5-8-18(21-13-15)24-11-3-4-12-24)22-17-7-6-16(14-20-17)23-9-1-2-10-23/h5-8,13-14H,1-4,9-12H2,(H,20,22,25)
InChIKeyKTVRZMPZSHTLJV-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.93
Rot. Bonds4

About 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide

6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 154735988) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
PubChem CID154735988
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)cn1)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C19H23N5O/c25-19(15-5-8-18(21-13-15)24-11-3-4-12-24)22-17-7-6-16(14-20-17)23-9-1-2-10-23/h5-8,13-14H,1-4,9-12H2,(H,20,22,25)
InChIKeyKTVRZMPZSHTLJV-UHFFFAOYSA-N
XLogP2.93
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide (CID 154735988) is 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide is O=C(Nc1ccc(N2CCCC2)cn1)c1ccc(N2CCCC2)nc1.
What is the InChIKey of 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is KTVRZMPZSHTLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c25-19(15-5-8-18(21-13-15)24-11-3-4-12-24)22-17-7-6-16(14-20-17)23-9-1-2-10-23/h5-8,13-14H,1-4,9-12H2,(H,20,22,25).
What are the key properties of 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide?
6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 337.43 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 154735988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).