N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride

C10H16ClN3O2 — CID 119515208

IUPACN-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
SMILESCCOCCC(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-2-15-6-5-10(14)13-8-3-4-9(11)12-7-8;/h3-4,7H,2,5-6H2,1H3,(H2,11,12)(H,13,14);1H
InChIKeyBNXNXQUIKXKCFB-UHFFFAOYSA-N
MW245.71 g/mol
LogP1.45
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride

N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride (PubChem CID 119515208) has the molecular formula C10H16ClN3O2 and a molecular weight of 245.71 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
PubChem CID119515208
Molecular FormulaC10H16ClN3O2
Molecular Weight245.71 g/mol
Exact Mass245.09
IUPAC NameN-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
SMILESCCOCCC(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-2-15-6-5-10(14)13-8-3-4-9(11)12-7-8;/h3-4,7H,2,5-6H2,1H3,(H2,11,12)(H,13,14);1H
InChIKeyBNXNXQUIKXKCFB-UHFFFAOYSA-N
XLogP1.45
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.71
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide
CID 119516391
N-(6-amino-3-pyridinyl)-N',N'-diethylpentanediamide;hydrochloride
CID 119515259
N-(6-amino-3-pyridinyl)-N',N'-dipropylbutanediamide
CID 119515057
N-(6-amino-3-pyridinyl)-N',N'-dipropylpentanediamide
CID 119516549
N-(4-chlorophenyl)-3-ethoxypropanamide
CID 2972757
N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
CID 119515078
N-[4-(1-amino-2-methylpropan-2-yl)phenyl]-3-ethoxypropanamide
CID 55091452
N-(6-amino-3-pyridinyl)-3-(3,4-dimethylphenyl)sulfanylpropanamide;hydrochloride
CID 119516033
N-(6-amino-3-pyridinyl)-2-ethoxypropanamide
CID 119516288
2-[4-(3-ethoxypropanoylamino)phenoxy]acetic acid
CID 55242073
3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide
CID 112738961
N-(6-amino-3-pyridinyl)-3-(2-methylphenyl)propanamide
CID 62901141

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride (CID 119515208) is N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride is CCOCCC(=O)Nc1ccc(N)nc1.Cl.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride?
The InChIKey is BNXNXQUIKXKCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2.ClH/c1-2-15-6-5-10(14)13-8-3-4-9(11)12-7-8;/h3-4,7H,2,5-6H2,1H3,(H2,11,12)(H,13,14);1H.
What are the key properties of N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride?
N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride has a molecular weight of 245.71 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride is sourced from PubChem (CID 119515208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).