N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine

C13H20N4 — CID 82055043

IUPACN-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine
SMILESNNc1ccc(NCCC2=CCCCC2)nc1
InChIInChI=1S/C13H20N4/c14-17-12-6-7-13(16-10-12)15-9-8-11-4-2-1-3-5-11/h4,6-7,10,17H,1-3,5,8-9,14H2,(H,15,16)
InChIKeyBULDOSZDBSUQRX-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.67
Rot. Bonds5

About N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine

N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine (PubChem CID 82055043) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine
PubChem CID82055043
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine
SMILESNNc1ccc(NCCC2=CCCCC2)nc1
InChIInChI=1S/C13H20N4/c14-17-12-6-7-13(16-10-12)15-9-8-11-4-2-1-3-5-11/h4,6-7,10,17H,1-3,5,8-9,14H2,(H,15,16)
InChIKeyBULDOSZDBSUQRX-UHFFFAOYSA-N
XLogP2.67
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-3-phenylurea
CID 113010275
N-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-2-ethylbutanamide
CID 113010230
ethyl N-[5-[2-(cyclohexen-1-yl)ethylamino]-2-pyridinyl]carbamate
CID 113024981
N-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-2-methylbenzamide
CID 113010234
N-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-2,5-dimethylbenzenesulfonamide
CID 113010296
N-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-3,4-difluorobenzamide
CID 113010267
4-chloro-N-[5-[2-(cyclohexen-1-yl)ethylamino]-2-pyridinyl]benzenesulfonamide
CID 113024995
N-[5-[2-(cyclohexen-1-yl)ethylamino]-2-pyridinyl]oxane-4-carboxamide
CID 113024984
6-[2-(cyclohexen-1-yl)ethylamino]-N,N-diethylpyridine-3-carboxamide
CID 109152727
6-[2-(cyclohexen-1-yl)ethylamino]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109152684
6-[2-(cyclohexen-1-yl)ethylamino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide
CID 109152763
N-[2-(cyclohexen-1-yl)ethyl]-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 53126653

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine (CID 82055043) is N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine is NNc1ccc(NCCC2=CCCCC2)nc1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine?
The InChIKey is BULDOSZDBSUQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c14-17-12-6-7-13(16-10-12)15-9-8-11-4-2-1-3-5-11/h4,6-7,10,17H,1-3,5,8-9,14H2,(H,15,16).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine?
N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine has a molecular weight of 232.33 g/mol, XLogP of 2.67, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine is sourced from PubChem (CID 82055043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).