3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide

C13H20N4O2 — CID 105068500

IUPAC3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide
SMILESNc1cnccc1C(=O)NCCCN1CCOCC1
InChIInChI=1S/C13H20N4O2/c14-12-10-15-4-2-11(12)13(18)16-3-1-5-17-6-8-19-9-7-17/h2,4,10H,1,3,5-9,14H2,(H,16,18)
InChIKeyUGODIUIJDPQINQ-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.12
Rot. Bonds5

About 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide

3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide (PubChem CID 105068500) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide
PubChem CID105068500
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide
SMILESNc1cnccc1C(=O)NCCCN1CCOCC1
InChIInChI=1S/C13H20N4O2/c14-12-10-15-4-2-11(12)13(18)16-3-1-5-17-6-8-19-9-7-17/h2,4,10H,1,3,5-9,14H2,(H,16,18)
InChIKeyUGODIUIJDPQINQ-UHFFFAOYSA-N
XLogP0.12
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,4-diamino-N-(3-morpholin-4-ylpropyl)benzamide
CID 61092801
2-amino-4-chloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 43168459
N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride
CID 2909951
2-amino-4-methoxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 80503310
N-(3-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
CID 141309481
N-(3-morpholin-4-ylpropyl)-1,6-naphthyridine-8-carboxamide
CID 91949073
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide
CID 81226039
4-chloro-N-(3-piperidin-1-ylpropyl)pyridine-3-carboxamide
CID 81226066
N-(3-morpholin-4-ylpropyl)-2-propan-2-ylbenzamide
CID 143519809
2-N,5-N-bis(3-morpholin-4-ylpropyl)pyridine-2,5-dicarboxamide
CID 4595283
2-amino-4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 55138823

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide (CID 105068500) is 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide is Nc1cnccc1C(=O)NCCCN1CCOCC1.
What is the InChIKey of 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide?
The InChIKey is UGODIUIJDPQINQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-12-10-15-4-2-11(12)13(18)16-3-1-5-17-6-8-19-9-7-17/h2,4,10H,1,3,5-9,14H2,(H,16,18).
What are the key properties of 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide?
3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 105068500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).