3-[(5-amino-2-pyridinyl)amino]propanamide

C8H12N4O — CID 43553393

IUPAC3-[(5-amino-2-pyridinyl)amino]propanamide
SMILESNC(=O)CCNc1ccc(N)cn1
InChIInChI=1S/C8H12N4O/c9-6-1-2-8(12-5-6)11-4-3-7(10)13/h1-2,5H,3-4,9H2,(H2,10,13)(H,11,12)
InChIKeyWIACUYLCDUXOTC-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.05
Rot. Bonds4

About 3-[(5-amino-2-pyridinyl)amino]propanamide

3-[(5-amino-2-pyridinyl)amino]propanamide (PubChem CID 43553393) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-[(5-amino-2-pyridinyl)amino]propanamide.

Molecular Properties

Compound Name3-[(5-amino-2-pyridinyl)amino]propanamide
PubChem CID43553393
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name3-[(5-amino-2-pyridinyl)amino]propanamide
SMILESNC(=O)CCNc1ccc(N)cn1
InChIInChI=1S/C8H12N4O/c9-6-1-2-8(12-5-6)11-4-3-7(10)13/h1-2,5H,3-4,9H2,(H2,10,13)(H,11,12)
InChIKeyWIACUYLCDUXOTC-UHFFFAOYSA-N
XLogP-0.05
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N,N'-bis[2-[(5-amino-2-pyridinyl)amino]ethyl]hexanediamide
CID 163474647
4-[(5-amino-2-pyridinyl)amino]butan-2-ol
CID 64928844
N-[2-[(5-amino-2-pyridinyl)amino]ethyl]-2,2-dimethylpropanamide
CID 82331443
ethyl 6-[(3-amino-3-oxopropyl)amino]pyridine-3-carboxylate
CID 43532828
5-[(5-amino-2-pyridinyl)amino]pentan-2-ol
CID 106119738
N-[2-[(5-amino-2-pyridinyl)amino]ethyl]-2-phenylacetamide
CID 82331463
N-[3-[(5-amino-2-pyridinyl)amino]propyl]-2,2,2-trifluoroacetamide
CID 82331124
N-[3-[(5-amino-2-pyridinyl)amino]propyl]cyclopropanecarboxamide
CID 82331101
2-N-hexylpyridine-2,5-diamine
CID 21487111
4-[(5-aminopyrazin-2-yl)amino]butanamide
CID 80652340
5-[[5-(trifluoromethyl)-2-pyridinyl]amino]pentanamide
CID 114162427
2-N-ethylpyridine-2,5-diamine;hydrochloride
CID 134080457

Frequently Asked Questions

What is the IUPAC name of 3-[(5-amino-2-pyridinyl)amino]propanamide?
The IUPAC name of 3-[(5-amino-2-pyridinyl)amino]propanamide (CID 43553393) is 3-[(5-amino-2-pyridinyl)amino]propanamide.
What is the SMILES notation for 3-[(5-amino-2-pyridinyl)amino]propanamide?
The canonical SMILES for 3-[(5-amino-2-pyridinyl)amino]propanamide is NC(=O)CCNc1ccc(N)cn1.
What is the InChIKey of 3-[(5-amino-2-pyridinyl)amino]propanamide?
The InChIKey is WIACUYLCDUXOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-6-1-2-8(12-5-6)11-4-3-7(10)13/h1-2,5H,3-4,9H2,(H2,10,13)(H,11,12).
What are the key properties of 3-[(5-amino-2-pyridinyl)amino]propanamide?
3-[(5-amino-2-pyridinyl)amino]propanamide has a molecular weight of 180.21 g/mol, XLogP of -0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-amino-2-pyridinyl)amino]propanamide is sourced from PubChem (CID 43553393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).