5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide

C13H20N4O2 — CID 102859267

IUPAC5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1N(CCCO)C1CCC1
InChIInChI=1S/C13H20N4O2/c14-9-7-11(12(15)19)13(16-8-9)17(5-2-6-18)10-3-1-4-10/h7-8,10,18H,1-6,14H2,(H2,15,19)
InChIKeyVPKPOQPCPIVVHO-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.50
Rot. Bonds6

About 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide

5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide (PubChem CID 102859267) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide
PubChem CID102859267
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1N(CCCO)C1CCC1
InChIInChI=1S/C13H20N4O2/c14-9-7-11(12(15)19)13(16-8-9)17(5-2-6-18)10-3-1-4-10/h7-8,10,18H,1-6,14H2,(H2,15,19)
InChIKeyVPKPOQPCPIVVHO-UHFFFAOYSA-N
XLogP0.50
TPSA105.47 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-2-[cyclobutyl(2-hydroxyethyl)amino]pyridine-3-carboxamide
CID 102859460
ethyl 5-amino-2-[cyclopropyl(2-hydroxyethyl)amino]pyridine-3-carboxylate
CID 114047105
5-amino-2-[5-hydroxypentyl(methyl)amino]pyridine-3-carboxamide
CID 107197717
2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxylic acid
CID 102863145
5-amino-2-[cyclopentyl(2-hydroxyethyl)amino]pyridine-3-carbonitrile
CID 54993728
1-[2-[cyclobutyl(3-hydroxypropyl)amino]-3-pyridinyl]ethanone
CID 114055612
3-[(5-amino-3-bromo-4-methyl-2-pyridinyl)-cyclobutylamino]propan-1-ol
CID 102859445
3-[cyclobutyl-[5-(hydroxymethyl)pyrimidin-4-yl]amino]propan-1-ol
CID 114215177
5-amino-2-(diethylamino)pyridine-3-carboxamide
CID 61359746
5-amino-2-[methyl(propyl)amino]pyridine-3-carboxamide
CID 61358399
5-amino-2-[methyl(pentyl)amino]pyridine-3-carboxamide
CID 61358598
5-amino-2-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 61358208

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide (CID 102859267) is 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide is NC(=O)c1cc(N)cnc1N(CCCO)C1CCC1.
What is the InChIKey of 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide?
The InChIKey is VPKPOQPCPIVVHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-9-7-11(12(15)19)13(16-8-9)17(5-2-6-18)10-3-1-4-10/h7-8,10,18H,1-6,14H2,(H2,15,19).
What are the key properties of 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide?
5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[cyclobutyl(3-hydroxypropyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 102859267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).