2-[2-(diethylamino)-4-pyridinyl]ethanimidamide

C11H18N4 — CID 83882972

IUPAC2-[2-(diethylamino)-4-pyridinyl]ethanimidamide
SMILES[H]/N=C(\N)Cc1ccnc(N(CC)CC)c1
InChIInChI=1S/C11H18N4/c1-3-15(4-2)11-8-9(5-6-14-11)7-10(12)13/h5-6,8H,3-4,7H2,1-2H3,(H3,12,13)
InChIKeyNXZHGWDNITVLCB-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.41
Rot. Bonds5

About 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide

2-[2-(diethylamino)-4-pyridinyl]ethanimidamide (PubChem CID 83882972) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide.

Molecular Properties

Compound Name2-[2-(diethylamino)-4-pyridinyl]ethanimidamide
PubChem CID83882972
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-[2-(diethylamino)-4-pyridinyl]ethanimidamide
SMILES[H]/N=C(\N)Cc1ccnc(N(CC)CC)c1
InChIInChI=1S/C11H18N4/c1-3-15(4-2)11-8-9(5-6-14-11)7-10(12)13/h5-6,8H,3-4,7H2,1-2H3,(H3,12,13)
InChIKeyNXZHGWDNITVLCB-UHFFFAOYSA-N
XLogP1.41
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[2-[2-(dimethylamino)ethyl-ethylamino]-4-pyridinyl]ethanimidate
CID 123990601
2-pyridin-4-ylethanimidamide
CID 5078674
2-[cyclobutylmethyl(ethyl)amino]pyridine-4-carboximidamide
CID 107399029
2-[ethyl(2-methylbutyl)amino]pyridine-4-carboximidamide
CID 79477749
2-(3,4-diethoxyphenyl)ethanimidamide
CID 4071975
2-[4-(2-amino-2-iminoethyl)phenyl]ethanimidamide
CID 3685928
2-[ethyl(pyridin-4-ylmethyl)amino]pyridine-4-carbothioamide
CID 61449400
N,N-diethyl-4-methylpyridin-2-amine
CID 14197874
4-(aminomethyl)-N-ethyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 54948605
2-(3-ethoxy-4-hydroxyphenyl)ethanimidamide
CID 91756255
2-(3-ethoxyphenyl)ethanimidamide
CID 4114058
[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol
CID 63955026

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide?
The IUPAC name of 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide (CID 83882972) is 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide.
What is the SMILES notation for 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide?
The canonical SMILES for 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide is [H]/N=C(\N)Cc1ccnc(N(CC)CC)c1.
What is the InChIKey of 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide?
The InChIKey is NXZHGWDNITVLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-3-15(4-2)11-8-9(5-6-14-11)7-10(12)13/h5-6,8H,3-4,7H2,1-2H3,(H3,12,13).
What are the key properties of 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide?
2-[2-(diethylamino)-4-pyridinyl]ethanimidamide has a molecular weight of 206.29 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)-4-pyridinyl]ethanimidamide is sourced from PubChem (CID 83882972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).