N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine

C12H23N5 — CID 167130384

IUPACN-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine
SMILESCCNc1cc(C(C)NCCNNC)ccn1
InChIInChI=1S/C12H23N5/c1-4-14-12-9-11(5-6-16-12)10(2)15-7-8-17-13-3/h5-6,9-10,13,15,17H,4,7-8H2,1-3H3,(H,14,16)
InChIKeyUROMAFUBVLCRNR-UHFFFAOYSA-N
MW237.35 g/mol
LogP0.89
Rot. Bonds8

About N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine

N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine (PubChem CID 167130384) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine
PubChem CID167130384
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC NameN-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine
SMILESCCNc1cc(C(C)NCCNNC)ccn1
InChIInChI=1S/C12H23N5/c1-4-14-12-9-11(5-6-16-12)10(2)15-7-8-17-13-3/h5-6,9-10,13,15,17H,4,7-8H2,1-3H3,(H,14,16)
InChIKeyUROMAFUBVLCRNR-UHFFFAOYSA-N
XLogP0.89
TPSA61.01 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 50.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[[2-(ethylamino)-4-pyridinyl]amino]-4-methylpentan-2-ol
CID 107159665
N-ethyl-4-(3-methylbutan-2-ylsulfanyl)pyridin-2-amine
CID 107765564
N-ethyl-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine
CID 162617603
N-[1-(2-chloro-4-pyridinyl)ethyl]pentan-1-amine
CID 115705766
2-[[2-(ethylamino)-4-pyridinyl]-methylamino]propan-1-ol
CID 104557112
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(4-methyl-2-pyridinyl)-N'-pentan-2-ylethane-1,2-diamine
CID 142941016
3-[2-(ethylamino)-4-pyridinyl]propan-1-ol
CID 57075658
5-[[2-(ethylamino)-4-pyridinyl]amino]-2-methylpentan-1-ol
CID 114152288
4-[(4-fluoro-2-pyridinyl)amino]butan-2-ol
CID 130694376
2-N-ethyl-4-N-(4,4,4-trifluorobutan-2-yl)pyridine-2,4-diamine
CID 114131334
2-(ethylamino)-N-(3-hydroxybutyl)-N-methylpyridine-4-carboxamide
CID 115704020

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine?
The IUPAC name of N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine (CID 167130384) is N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine is CCNc1cc(C(C)NCCNNC)ccn1.
What is the InChIKey of N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine?
The InChIKey is UROMAFUBVLCRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-4-14-12-9-11(5-6-16-12)10(2)15-7-8-17-13-3/h5-6,9-10,13,15,17H,4,7-8H2,1-3H3,(H,14,16).
What are the key properties of N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine?
N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine has a molecular weight of 237.35 g/mol, XLogP of 0.89, 8 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[1-[2-(2-methylhydrazinyl)ethylamino]ethyl]pyridin-2-amine is sourced from PubChem (CID 167130384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).